A0A087X4T2_POEFO Loading...

Early growth response 2b

AlphaFold DB , UniProt , Accession A0A087X4T2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 446 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.3Very low31.8Very low240 Ų240160.3 Ų160.3100%1.18285%0.851SS**  0109.70-70.5179.5177.100108.9
2T34.6Very low31.4Very low143 Ų143159.1 Ų159.188%0.87785%0.845SS**  trans172.695.7141.330.10000105.9
3A32.5Very low31.4Very low100 Ų100159 Ų15983%0.82684%0.844SS**  trans-62.6136.5171.800000109.4
4K33.4Very low31.1Very low199 Ų199153.4 Ų153.487%0.86584%0.843SS**  trans-121.8109.1154.9-78.8-175.5178.2178.50108
5T31.3Very low30.9Very low130 Ų130147.5 Ų147.580%0.79883%0.832SS**  trans-36.1120.8168.336.60000113.2E7T5-E7 PolarHBondContact O-N 3.1Å
6L32.9Very low30.5Very low173 Ų173151.6 Ų151.691%0.90684%0.838SS**  trans-75.2105.5157.3-86.8159.1000107.6K8L6-K8 PolarHBondContact O-N 3.3Å; L6-K8 VanDerWaalsContact O-N 3.17Å
7E28.8Very low30.3Very low178 Ų178150.2 Ų150.283%0.83283%0.834SS**  trans-66109.1162.5-81.9-173145.900108.6T5 V9T5-E7 PolarHBondContact O-N 3.1Å; E7-V9 PolarHBondContact O-N 2.92Å
8K31.1Very low30.1Very low192 Ų192151.8 Ų151.884%0.83583%0.834SS**  trans-69.4107.4161.8-87.6177.7174.6176.20107.7L6 Q10L6-K8 PolarHBondContact O-N 3.3Å; L6-K8 VanDerWaalsContact O-N 3.17Å; K8-Q10 PolarHBondContact O-N 3.16Å
9V26.3Very low30Very low126 Ų126149.3 Ų149.376%0.76483%0.826SS**  trans-69.298160.4177.90000107.3E7 V11E7-V9 PolarHBondContact O-N 2.92Å; V9-V11 HydrophobicContact CG1-CG2 4.3Å; V9-V11 PolarHBondContact O-N 3.19Å
10Q27.1Very low29.8Very low166 Ų166149.3 Ų149.378%0.77683%0.83SS**  trans-69.2111.6165.3-83177-57.700108.6K8 N12K8-Q10 PolarHBondContact O-N 3.16Å; Q10-N12 PolarHBondContact O-N 3.09Å
11V28.1Very low29.7Very low116 Ų116146.5 Ų146.570%0.70383%0.826SS**  trans-88.899.4161-1730000106.6V9 L13V9-V11 HydrophobicContact CG1-CG2 4.3Å; V9-V11 PolarHBondContact O-N 3.19Å; V11-L13 PolarHBondContact O-N 2.82Å; V11-L13 VanDerWaalsContact O-N 3.17Å
12N27.2Very low28.8Very low146 Ų146142.8 Ų142.878%0.78181%0.811SS**  trans-69.6102.5169.1-107.3-40.9000108.5Q10Q10-N12 PolarHBondContact O-N 3.09Å
13L31.2Very low28.4Very low158 Ų158140.9 Ų140.983%0.82780%0.803SS**  trans-90.1111.4158.7-82.4157000106.7V11 G15V11-L13 PolarHBondContact O-N 2.82Å; V11-L13 VanDerWaalsContact O-N 3.17Å; L13-G15 PolarHBondContact O-N 3.17Å
14G27.6Very low28.1Very low81 Ų81142.2 Ų142.284%0.83580%0.801SS**  trans-56.5122.1-177.700000112.6
15G28.2Very low27.8Very low65 Ų65143.3 Ų143.367%0.6780%0.801SS**  trans73.591.7132.900000117.4L13L13-G15 PolarHBondContact O-N 3.17Å
16F24.8Very low27.4Very low213 Ų213142 Ų14293%0.93480%0.797SS**  -162.3111.9118.1-111.8-83.6000107.7
17V26.7Very low27.1Very low127 Ų127139.2 Ų139.277%0.7779%0.787SS**  trans-109.9125169.7178.90000106.5
18H26Very low27Very low180 Ų180137.5 Ų137.583%0.83378%0.784SS**  trans-157.8155.3144.1-103-70.1000108.2
19P29.7Very low26.8Very low104 Ų104135.3 Ų135.368%0.67578%0.781SS**  -110.4150.6-125.335.7-22.7000111
20V26.1Very low26.8Very low149 Ų149137.3 Ų137.390%0.90379%0.786SS**  trans-128.7130159.4-172.70000108
21A27.4Very low26.8Very low91 Ų91134 Ų13475%0.75279%0.787SS**  trans-57.5148.3-161.500000114.8S23A21-S23 PolarHBondContact O-N 3.32Å
22D24.1Very low26.7Very low162 Ų162132.7 Ų132.787%0.86679%0.788SS**  trans-54.8121.9160-64.2-53.6000110.4
23S26.3Very low26.7Very low103 Ų103131 Ų13172%0.7279%0.787SS**  trans-146101.7146.373.70000109.2A21A21-S23 PolarHBondContact O-N 3.32Å
24V26Very low26.5Very low127 Ų127131.6 Ų131.677%0.7779%0.791SS**  trans-76.6118.3168.3-178.20000107.5
25Y26.2Very low26.5Very low223 Ų223133.1 Ų133.188%0.87579%0.786SS**  trans-117.7133151.3-83.2-80.1000107.9
26S24.4Very low26.4Very low101 Ų101135.7 Ų135.771%0.70679%0.789SS**  trans-89.8146.6-173.8-130.20000111.5
27V25.5Very low26.4Very low116 Ų116131 Ų13170%0.70378%0.782SS**  trans26.6109.1152.4-790000119.2
28D27.2Very low26.3Very low142 Ų142131.9 Ų131.976%0.75979%0.788SS**  174.314195.9-87.1-36.4000112.2
29D26.3Very low26.3Very low146 Ų146126.5 Ų126.578%0.78177%0.774SS**  trans60.3111.6161.7-61.5-30000122.1
30I27.6Very low25.9Very low168 Ų168129.5 Ų129.586%0.86278%0.783SS**  -168.5128.7100.6-86.6154.2000109.8
31A25.5Very low25.9Very low96 Ų96131 Ų13179%0.79378%0.778SS**  trans-54.3133.3172.600000113.9
32A26.6Very low26Very low89 Ų89132.2 Ų132.274%0.73678%0.778SS**  trans-165.9123.9143.300000110.8
33S27.4Very low26.2Very low109 Ų109132.6 Ų132.676%0.76278%0.78SS**  trans56.390.4152.5660000118
34L27.1Very low26.2Very low171 Ų171132.6 Ų132.690%0.89579%0.786SS**  -163.3124.1117.6-95.4162.5000107.3
35P27.4Very low26.2Very low113 Ų113133.8 Ų133.873%0.73479%0.788SS**  trans-124.9121.6132.930.8-20.6000110
36T26.1Very low26.4Very low119 Ų119131.2 Ų131.273%0.7379%0.789SS**  26.5134.9121.141.70000118.5
37S25.7Very low26.4Very low114 Ų114129.9 Ų129.980%0.79779%0.791SS**  trans81102.6154.6660000117.4
38V24.2Very low26.4Very low147 Ų147128.9 Ų128.989%0.89180%0.795SS**  trans-111.5108.9147.5176.40000107.3
39A24.9Very low26.4Very low67 Ų67129.5 Ų129.555%0.55479%0.793SS**  trans-66.3139.6164.200000109.6F41A39-F41 HydrophobicContact CB-CD2 4.15Å; A39-F41 HydrophobicContact CB-CE2 3.95Å
40I23.2Very low26.3Very low166 Ų166131.3 Ų131.385%0.85179%0.79SS**  trans-85.3116.6168.7-60.7170.1000106.6
41F25.1Very low26.2Very low181 Ų181128.9 Ų128.979%0.79478%0.778SS**  trans-118.8140.7160.6-77-76.6000109.6A39A39-F41 HydrophobicContact CB-CD2 4.15Å; A39-F41 HydrophobicContact CB-CE2 3.95Å
42P30.1Very low26.4Very low116 Ų116130.7 Ų130.775%0.75377%0.771SS**  trans-80.2150.5-173.533.4-33.1000111.8
43N27.5Very low26.5Very low171 Ų171135.8 Ų135.891%0.91478%0.782SS**  trans-56.1133179-76.6-34.8000112.7
44A26.1Very low26.5Very low103 Ų103136.8 Ų136.885%0.85178%0.778SS**  trans-135.2153.8158.100000109.6
45D26.7Very low26.5Very low152 Ų152135 Ų13581%0.81378%0.775SS**  trans-74.2175-156.5-140.6-32.2000115.9
46L29.5Very low26.3Very low169 Ų169133.7 Ų133.789%0.88577%0.773SS**  trans94.6124.4160.4-60.2154000119.9
47G24.6Very low26.3Very low73 Ų73132.3 Ų132.375%0.75377%0.774SS**  122.577.5125.400000119
48A26.1Very low26.4Very low94 Ų94134 Ų13478%0.77777%0.774SS**  46.8140.5128.800000123.7
49H25.9Very low26.6Very low155 Ų155131.5 Ų131.572%0.71876%0.762SS**  trans104.2109.5136.7-109.5-81.7000120.5
50Y24.6Very low26.9Very low185 Ų185135.3 Ų135.373%0.72577%0.773SS**  trans58.7136.8135.5-88.3-125.1000118.3
51D27.1Very low27.3Very low116 Ų116135.9 Ų135.962%0.6277%0.774SS**  cis-155.7130.223.7-100.4-45.8000107.9
52Q29.6Very low27.4Very low135 Ų135130.5 Ų130.563%0.63177%0.769SS**  72.4105.787.7-162.7167.245.400114.5
53M28.7Very low27.2Very low196 Ų196129.3 Ų129.397%0.96677%0.77SS**  -143.9119.3121.8-74.9-146.8178.100110.2
54N27.4Very low27.1Very low129 Ų129129 Ų12969%0.6977%0.768SS**  trans-66.1158.9176.3-87.1-26000112.1
55V26.1Very low27.4Very low135 Ų135133 Ų13382%0.81877%0.771SS**  172.3129.296.6162.50000110.9
56A24.3Very low27.3Very low85 Ų85133.3 Ų133.370%0.70277%0.773SS**  trans59.2112.9155.500000118.8
57A24.9Very low27.2Very low90 Ų90129.2 Ų129.274%0.74476%0.764SS**  cis66.910648.700000114.1
58D27Very low27.3Very low150 Ų150135.1 Ų135.180%0.80277%0.771SS**  -165.7114.1126.6-96.1-33.4000108.3
59S29.3Very low27.4Very low93 Ų93140.2 Ų140.265%0.6578%0.776SS**  71.7131.985.3-62.80000111.4
60L31.5Very low27.3Very low148 Ų148144.8 Ų144.878%0.77579%0.787SS**  cis-178.3152.411.5-116.2167.7000109.3
61M31.6Very low27.2Very low178 Ų178141.1 Ų141.188%0.87779%0.788SS**  trans95.6123.2141.6-65.8-67.2-111.400125.3
62G26.9Very low27.1Very low67 Ų67142.3 Ų142.369%0.69180%0.8SS**  trans125.980.114300000114.9
63A26.1Very low26.8Very low92 Ų92144.7 Ų144.776%0.7681%0.811SS**  43.5122.787.100000113.8
64D24.3Very low26.6Very low165 Ų165143.9 Ų143.988%0.88281%0.81SS**  -151.9146.968.7-96.6-37.1000114.9
65M32.4Very low26.4Very low185 Ų185143.1 Ų143.191%0.91181%0.814SS**  trans-101.6142.6163.9-73.3-92.7175.600108.4
66N25.9Very low26.4Very low159 Ų159141.9 Ų141.985%0.8581%0.812SS**  trans-134.6126.7150.7-161.211.4000110
67A26.9Very low26.3Very low84 Ų84149 Ų14969%0.69482%0.822SS**  trans-113.3133.5-179.700000108.1
68E27.2Very low26.3Very low196 Ų196148.8 Ų148.892%0.91682%0.815SS**  trans-124.3118.8161.2-132.417812600108.6
69K27.3Very low26.3Very low201 Ų201147.4 Ų147.487%0.87482%0.817SS**  trans-78.3137.8-178.3-71.3173.2176177.70110.1
70R24Very low26.1Very low251 Ų251146.5 Ų146.595%0.94782%0.823SS**  trans-144116.7144.9-127173.7-179.7147.9-0.7110.1
71S22.5Very low25.7Very low108 Ų108149.3 Ų149.376%0.75583%0.829SS**  trans-79.6140.2179.835.80000111.9
72V24.2Very low25.4Very low142 Ų142145.6 Ų145.686%0.86182%0.821SS**  trans-141.6123.6152.8179.80000107.8
73E23.4Very low25.6Very low185 Ų185151.2 Ų151.286%0.86483%0.829SS**  trans-67.6145.3176.2-61.2-177135.400111.5
74L24.5Very low25.6Very low179 Ų179152.8 Ų152.894%0.93783%0.831SS**  trans-110.2103.3162.6-101.5124.1000108.4
75S24.1Very low25.9Very low112 Ų112149.6 Ų149.678%0.78383%0.828SS**  trans-70.5130.816853.40000110.9
76S25.9Very low25.7Very low110 Ų110146.1 Ų146.177%0.76982%0.822SS**  trans-60.8135.9163.244.40000112.7
77Y22.3Very low26.1Very low233 Ų233147.2 Ų147.291%0.91482%0.821SS**  trans-146.2140.7148.2-131.1-91.5000110.6
78S25.1Very low26.3Very low87 Ų87153.6 Ų153.661%0.60883%0.828SS**  trans-90.7151.8-165.750.20000114.6
79S27.7Very low26.5Very low120 Ų120151.4 Ų151.484%0.83982%0.822SS**  trans61.5124.6141.762.70000121.3
80G23.7Very low26.8Very low75 Ų75148.7 Ų148.777%0.77381%0.813SS**  trans-176.777.3162.100000114.3
81F24.3Very low27.2Very low207 Ų207143.2 Ų143.291%0.90881%0.807SS**  trans54.8136.6148-106-100.8000124.1
82S25Very low27.7Very low99 Ų99146.3 Ų146.369%0.69281%0.807SS**  trans93.995.5148.2-45.80000119.3
83Q31.2Very low28.2Very low185 Ų185144.9 Ų144.986%0.86480%0.799SS**  trans-67.4154.4148.8-72.4-178.8-27.800110.4
84P26.2Very low28.5Very low125 Ų125146.3 Ų146.381%0.81280%0.798SS**  -115133.4128.232-27.4000110.5
85A30.8Very low28.8Very low98 Ų98145 Ų14581%0.8179%0.789SS**  trans-63.8128.3169.900000110.3
86S26.7Very low29.1Very low112 Ų112141.1 Ų141.178%0.78377%0.767SS**  trans-145.7115.6158.1-174.90000108.4R88S86-R88 PolarHBondContact O-N 3.31Å
87H36.1Very low29.4Very low182 Ų182146.1 Ų146.184%0.84378%0.775SS**  trans-46.2118.1172.3-101.9-108.5000110.6
88R30.6Very low29.9Very low219 Ų219142.8 Ų142.883%0.82677%0.765SS**  trans-131.5110.1162.6-113179.4175.3175.3-0.4108.6S86 Q90S86-R88 PolarHBondContact O-N 3.31Å; R88-Q90 PolarHBondContact O-N 3.38Å; R88-Q90 VanDerWaalsContact O-N 3.07Å
89N30.6Very low30.1Very low149 Ų149144.5 Ų144.580%0.79778%0.777SS**  trans-59.5109168.5-59-16.4000107.5
90Q33.8Very low30.4Very low145 Ų145145.7 Ų145.768%0.67877%0.773SS**  trans-93.4104.7176-69.9-176.920.400109.2R88 F92R88-Q90 PolarHBondContact O-N 3.38Å; R88-Q90 VanDerWaalsContact O-N 3.07Å; Q90-F92 HydrophobicContact CB-CD2 4.26Å; Q90-F92 HydrophobicContact CB-CE2 3.84Å; Q90-F92 VanDerWaalsContact OE1-CZ 3.3Å
91T32.9Very low30.6Very low136 Ų136150.1 Ų150.183%0.83478%0.779SS**  trans-77113.1162.1-1.60000108.1
92F32Very low31.1Very low173 Ų173145.3 Ų145.376%0.75977%0.77SS**  trans-87.4108.1170.9-78.3-90000109.4Q90Q90-F92 HydrophobicContact CB-CD2 4.26Å; Q90-F92 HydrophobicContact CB-CE2 3.84Å; Q90-F92 VanDerWaalsContact OE1-CZ 3.3Å
93T34.6Very low31.8Very low112 Ų112149 Ų14969%0.68778%0.777SS**  trans-90.3106.3170.6-50.50000108.9M95T93-M95 HydrophobicContact CG2-CE 4.12Å
94Y30.9Very low31.9Very low214 Ų214150.5 Ų150.584%0.83978%0.776SS**  trans-84.1118.9170.7-165-98000109.5
95M30.2Very low32.3Very low152 Ų152150.8 Ų150.875%0.74978%0.778SS**  trans-99.680.4171.9-77.7-85162.600108.7T93T93-M95 HydrophobicContact CG2-CE 4.12Å
96G31.6Very low32.5Very low31 Ų31149 Ų14932%0.3277%0.77SS.*  trans-92.2130.7171.100000110.6
97K31.2Very low33.2Very low215 Ų215151.8 Ų151.894%0.93578%0.775SS**  trans-84.2115.5165.6-76-176.8175.8-177.50108.4
98F33Very low33.1Very low163 Ų163154.1 Ų154.172%0.71578%0.777SS**  trans-107.8135.416434.2-89.5000108.8
99S28.1Very low33.5Very low123 Ų123151.3 Ų151.386%0.8678%0.778SS**PPolyproline II helixtrans-99.9125.9167.9-68.80000107.6
100I34.7Very low33.9Very low145 Ų145149.6 Ų149.674%0.74478%0.775SS**PPolyproline II helixtrans-97.4116.9166.8-60.9170.7000105.1S102I100-S102 PolarHBondContact O-N 3.36Å
101D28.1Very low33.9Very low168 Ų168151.9 Ų151.990%0.89879%0.786SS**PPolyproline II helixtrans-68119.3168.9-92.5-35.1000108.3
102S34.1Very low34Very low105 Ų105148.4 Ų148.473%0.73478%0.777SS**  trans-113.9111.3173.3-153.70000108.9I100 Y104I100-S102 PolarHBondContact O-N 3.36Å; S102-Y104 PolarHBondContact O-N 3.45Å; S102-Y104 VanDerWaalsContact O-N 3.17Å
103Q41.1Very low34.2Very low177 Ų177145.4 Ų145.483%0.82777%0.773SS**  trans-63.9107.4161.2-70.117511.300107
104Y32.5Very low34.1Very low216 Ų216146.7 Ų146.785%0.84777%0.774SS**SBendtrans155.4137.7149.6-85.1-67.7000110.3S102 G106S102-Y104 PolarHBondContact O-N 3.45Å; S102-Y104 VanDerWaalsContact O-N 3.17Å; Y104-G106 PolarHBondContact O-N 2.93Å
105P35.6Very low34Very low132 Ų132143 Ų14386%0.85777%0.769SS**  trans-90.7108.6-172.334.1-28.2000110.8
106G33.4Very low34.2Very low61 Ų61142.8 Ų142.863%0.62977%0.769SS**  trans-161.7123.7175.300000111.5Y104 W108Y104-G106 PolarHBondContact O-N 2.93Å; G106-W108 PolarHBondContact O-N 3.31Å
107N42.6Very low34.2Very low169 Ų169147.5 Ų147.590%0.90479%0.791SS**  trans-63.297.4-172.4-165.948.3000112.4
108W32.7Very low34.3Very low231 Ų231142.2 Ų142.288%0.87578%0.782SS**  trans-138.1129.4164.8-69.988000109.4G106 P110G106-W108 PolarHBondContact O-N 3.31Å; W108-P110 WeakPolarHBondContact O-CD 3.38Å
109N40.4Very low34.3Very low161 Ų161137.5 Ų137.586%0.86178%0.779SS**  trans-103.8107.1170.9-136.922000106.8
110P38.5Very low34.8Very low112 Ų112139.1 Ų139.173%0.72778%0.776SS**  trans-109.389.116635-23.3000109W108 G112W108-P110 WeakPolarHBondContact O-CD 3.38Å; P110-G112 PolarHBondContact O-N 2.82Å
111E34Very low34.6Very low193 Ų193141.3 Ų141.390%0.90278%0.781SS**  trans-8669.5149.1-72.1-153166.600107.6
112G34.2Very low34.8Very low63 Ų63140.8 Ų140.865%0.64978%0.778SS**  trans-88.9124.3166.800000109.2P110P110-G112 PolarHBondContact O-N 2.82Å
113V35.9Very low34.7Very low111 Ų111141.7 Ų141.767%0.67378%0.779SS**  trans-82115168.3177.80000107.3N115V113-N115 PolarHBondContact O-N 3.49Å
114I32.8Very low34.4Very low138 Ų138137.8 Ų137.871%0.70878%0.777SS**  trans-78.6115.8170-57.5173.5000107.4I116I114-I116 HydrophobicContact CG2-CG1 4.16Å
115N30.2Very low34.6Very low138 Ų138136 Ų13674%0.73878%0.776SS**  trans-87107.8167.3-76.1-31.4000108.4V113 V117V113-N115 PolarHBondContact O-N 3.49Å; N115-V117 PolarHBondContact O-N 3.07Å
116I34Very low35Very low146 Ų146135.3 Ų135.375%0.74977%0.771SS**  trans-84.1111.4165-56.2175.8000106.8I114I114-I116 HydrophobicContact CG2-CG1 4.16Å
117V31.3Very low35.9Very low130 Ų130138.2 Ų138.279%0.78878%0.779SS**  trans-89.2105.5170-179.80000107.3N115N115-V117 PolarHBondContact O-N 3.07Å
118S33.7Very low36.5Very low105 Ų105135.9 Ų135.973%0.73477%0.773SS**PPolyproline II helixtrans-78.7123.5167.1-67.60000109.4
119G33.1Very low37.3Very low63 Ų63130.6 Ų130.665%0.64977%0.769SS**PPolyproline II helixtrans-69.1150.2174.700000112.8F121G119-F121 PolarHBondContact O-N 3.33Å
120I37.3Very low37.9Very low158 Ų158128.6 Ų128.681%0.8177%0.765SS**PPolyproline II helixtrans-78.5116.8179-52.4170000108.5
121F32Very low38.8Very low191 Ų191129 Ų12984%0.83877%0.767SS**  trans-93.5114.8162.7-88.3-91.4000108.8G119 V123G119-F121 PolarHBondContact O-N 3.33Å; F121-V123 PolarHBondContact O-N 3.18Å
122N31.4Very low39.3Very low156 Ų156125.5 Ų125.583%0.83476%0.761SS**  trans-76.3108166.9-82.8-24.1000108.6
123V32.5Very low39.8Very low125 Ų125128.8 Ų128.876%0.75877%0.771SS**  trans-96.9111.1165.2-179.40000107.3F121 Q125F121-V123 PolarHBondContact O-N 3.18Å; V123-Q125 PolarHBondContact O-N 3.47Å
124A33.3Very low40Very low94 Ų94129 Ų12978%0.77778%0.778SS**PPolyproline II helixtrans-67.7125.3172.500000109.5
125Q38.3Very low40.3Very low180 Ų180127.8 Ų127.884%0.84178%0.781SS**PPolyproline II helixtrans-80.3139.8174.8-70.5-169.3-15.600111V123V123-Q125 PolarHBondContact O-N 3.47Å
126P42.9Very low40.6Very low116 Ų116126.2 Ų126.275%0.75378%0.781SS**PPolyproline II helixtrans-72.6152.517029.6-32.4000111.7
127P53.2Low40.7Very low122 Ų122123.9 Ų123.979%0.79278%0.784SS**PPolyproline II helixtrans-70.1151.6-173.128.2-34.8000113.5
128P54.6Low41Very low120 Ų120122.7 Ų122.778%0.77978%0.781SS**PPolyproline II helixtrans-75.2152.6-177.330.2-34.9000113.7
129P48.8Very low41.2Very low120 Ų120122.5 Ų122.578%0.77978%0.78SS**PPolyproline II helixtrans-75.9157.4179.230.8-34.7000113.7
130P53.7Low41.5Very low120 Ų120124.9 Ų124.978%0.77979%0.786SS**PPolyproline II helixtrans-77.9155.7-172.731.2-35.7000114.5
131P57.1Low42.3Very low119 Ų119123.1 Ų123.177%0.77379%0.785SS**PPolyproline II helixtrans-81151.3179.332-34.5000114
132P45.8Very low42.4Very low121 Ų121118.1 Ų118.179%0.78678%0.779SS**PPolyproline II helixtrans-81.3163.5176.332.7-34.3000114
133P43.7Very low42.6Very low132 Ų132115.4 Ų115.486%0.85777%0.773SS**PPolyproline II helixtrans-90.7149.1-154.734.8-35.1000114.9
134S41Very low42.7Very low116 Ų116114.9 Ų114.981%0.81178%0.775SS**  trans-125.1109.9160.758.40000110.4
135S37.4Very low42.7Very low112 Ų112113.8 Ų113.878%0.78377%0.772SS**  trans-44.6149.5156.444.60000111.6
136S37.4Very low42.5Very low105 Ų105110.7 Ų110.773%0.73477%0.771SS**  cis-175.9148.514.3370000107.9
137A35.8Very low42.9Very low97 Ų97110 Ų11080%0.80277%0.766SS**  trans56.7136.9145.600000118.6
138S36.9Very low42Very low105 Ų105111.4 Ų111.473%0.73476%0.762SS**  cis-169.8154.318.836.60000110.4
139S39Very low41Very low101 Ų101112.1 Ų112.171%0.70675%0.754SS**  trans65.786.5148.856.60000119.5
140S38.5Very low40.1Very low112 Ų112115.1 Ų115.178%0.78376%0.756SS**  31.2161.198.6-37.10000120.2
141P54.1Low39.2Very low121 Ų121113.6 Ų113.679%0.78675%0.747SS**  -143-147.4-92.636.1-10.5000110.4
142A34.5Very low38.1Very low87 Ų87113.4 Ų113.472%0.71975%0.749SS**  trans93.8137.1154.600000114.3
143S35.9Very low37.4Very low99 Ų99111 Ų11169%0.69275%0.747SS**  cis-179.1160.23.231.90000108
144S35.7Very low36.8Very low114 Ų114109.1 Ų109.180%0.79774%0.742SS**  trans48.7118.2145.761.60000117.5
145G31.7Very low36.5Very low71 Ų71111.8 Ų111.873%0.73275%0.746SS**  138.2134.157.500000106.2
146S34.9Very low36.2Very low115 Ų115110.9 Ų110.980%0.80474%0.74SS**  trans-60.7171.8172.3-53.60000110.7
147P51.6Low35.9Very low102 Ų102111 Ų11166%0.66274%0.739SS**  cis-153.1-174.332.225.15.1000117.9
148H33.6Very low35.8Very low150 Ų150111.8 Ų111.869%0.69473%0.734SS**  trans106.1114.9149.6-68.2-69.3000121.6
149H33.4Very low35.7Very low135 Ų135114.8 Ų114.863%0.62574%0.739SS**  83.8128123.1-84.8-59.2000124.4
150F31.2Very low35.5Very low184 Ų184114.5 Ų114.581%0.80774%0.742SS**  trans65.7151.7141.7-74.4-61.2000117.5
151S34.3Very low35.3Very low87 Ų87113.1 Ų113.161%0.60874%0.738SS**  cis-178.6130.8-7.3-179.50000105.8
152S34.1Very low34.5Very low116 Ų116115.8 Ų115.881%0.81174%0.74SS**  trans60.6142.8134.2-51.80000124
153G30.7Very low34.7Very low71 Ų71116.2 Ų116.273%0.73274%0.738SS**  trans97.2103.3154.200000113.7
154A31.8Very low34.9Very low92 Ų92119.8 Ų119.876%0.7674%0.744SS**  79.2133.659.400000114.7
155L34.8Very low35Very low171 Ų171118.6 Ų118.690%0.89574%0.74SS**  trans82.6140.9159.8-50.4-178.2000116.6
156S30.4Very low34.9Very low93 Ų93121.5 Ų121.565%0.6574%0.739SS**  cis-179.5154.8-7.4-164.50000109.6
157C30Very low34.9Very low107 Ų107122.6 Ų122.672%0.72374%0.735SS**  trans65.1149.8149.6-680000120.5
158T33.8Very low33.9Very low114 Ų114123.7 Ų123.770%0.69974%0.735SS**  cis-171.7145.9-2.323.70000105.9
159M36Very low34Very low169 Ų169123.5 Ų123.583%0.83374%0.735SS**  171.7118.295.2-79.9-78.6-175.800105.8
160A34.3Very low34.1Very low94 Ų94123.4 Ų123.478%0.77773%0.734SS**  97.210892.500000113.9
161A34.7Very low34.3Very low84 Ų84124 Ų12469%0.69474%0.739SS**  155.1134.1108.900000113.9
162Q38.2Very low34.4Very low177 Ų177127 Ų12783%0.82774%0.743SS**  trans89.588148.5-74.7147.50.800121.1
163S37.8Very low34.4Very low95 Ų95128.5 Ų128.566%0.66474%0.741SS**  74.4112.6111.965.10000121.5
164Q40.4Very low34.5Very low175 Ų175136.5 Ų136.582%0.81875%0.751SS**  trans58.4132.9140.1-9487.6400119.5
165A38.4Very low34.6Very low88 Ų88137.2 Ų137.273%0.72775%0.751SS**  cis-152.2136.323.200000113.5
166D29.3Very low35.4Very low132 Ų132134.9 Ų134.971%0.70675%0.746SS**  trans17.8148.4131.7-84.4-99.9000121.1
167L34.3Very low36.2Very low138 Ų138136.3 Ų136.372%0.72375%0.752SS**  cis-175.8141.4-16.4-148.477.8000106.4
168D30.7Very low37.1Very low125 Ų125136.7 Ų136.767%0.66875%0.754SS**  trans-50.9164.6164.5-93.5-85.8000115.5
169H35.6Very low37.9Very low147 Ų147137.4 Ų137.468%0.68176%0.76SS**  -178.7116.9104-9470.1000114.6
170H35.5Very low37.8Very low132 Ų132140.6 Ų140.661%0.61177%0.765SS**  55.7120.2127.9-79.7-89.9000122.3
171H35.6Very low37.7Very low196 Ų196141.5 Ų141.591%0.90777%0.765SS**  trans-117.3120152-96.7-84.9000110.8
172H36.1Very low37.6Very low152 Ų152143.6 Ų143.670%0.70478%0.775SS**  trans-97133.9164.6-103.5-85.7000110.4
173L33.9Very low37.4Very low146 Ų146140.5 Ų140.576%0.76477%0.773SS**  trans18.2121.6146.9-60.6167.2000119.1
174Y32.9Very low37.1Very low240 Ų240139.7 Ų139.794%0.94178%0.779SS**  trans-163137.9136.8-108.2-78.1000112.1
175S33.3Very low36.7Very low107 Ų107137.6 Ų137.675%0.74878%0.782SS**PPolyproline II helixtrans-64.8154.6177.9-56.70000114.6
176P53Low36.3Very low122 Ų122137.2 Ų137.279%0.79279%0.787SS**PPolyproline II helixtrans-92.2146174.233.8-32.4000114.6
177P47.3Very low36.3Very low122 Ų122139.6 Ų139.679%0.79279%0.794SS**PPolyproline II helixtrans-93.2169.3170.736.3-32.1000114
178P48Very low36.3Very low116 Ų116138.6 Ų138.675%0.75379%0.793SS**PPolyproline II helixtrans-88.1172.7-161.435.9-36.2000115.8
179P50.3Low36.4Very low129 Ų129142.3 Ų142.384%0.83880%0.799SS**PPolyproline II helixtrans-83.6145.5-166.532.7-34000114.7
180Y34.6Very low36.3Very low236 Ų236143.6 Ų143.693%0.92581%0.806SS**PPolyproline II helixtrans-70.9135.6179.9-85-92.3000114.4
181S31.4Very low36.2Very low112 Ų112143.8 Ų143.878%0.78381%0.812SS**PPolyproline II helixtrans-73.1125.2165-33.50000110.6
182S32.5Very low36.5Very low128 Ų128139.6 Ų139.690%0.89580%0.801SS**  trans-97.496170.766.50000110.9
183S35.2Very low36.6Very low112 Ų112138.5 Ų138.578%0.78381%0.811SS**  trans-125.8106.2159.153.80000107.6
184G30.7Very low36.6Very low78 Ų78135.8 Ų135.880%0.80481%0.81SS**  trans-137.5101.2176.800000109.2
185C31.8Very low36.6Very low131 Ų131134.5 Ų134.589%0.88581%0.809SS**  trans-66.3134.5165-510000107.9
186G29.5Very low36.7Very low80 Ų80137 Ų13783%0.82581%0.813SS**  trans-85.3115.9173.100000110
187E30.9Very low35.6Very low182 Ų182137 Ų13785%0.8582%0.816SS**  trans-126124153.2-79.7-153126.700109.8
188V34Very low34.9Very low117 Ų117137.5 Ų137.571%0.70982%0.817SS**  trans42.3113.6138.1-166.10000118.3
189Y32.3Very low34.2Very low203 Ų203137.8 Ų137.880%0.79682%0.822SS**  trans-74.3117.2170.1-164.4-96000110.6
190Q33.8Very low33.3Very low174 Ų174136.9 Ų136.981%0.81382%0.819SS**  trans-143117.4154.6-108.397.725.400109.1
191D32.5Very low33.2Very low137 Ų137131.5 Ų131.573%0.73381%0.814SS**  trans-82.1151.3171.2-131.5-5.1000110.1
192P42.3Very low33.8Very low107 Ų107131.8 Ų131.870%0.69581%0.814SS**  trans-97.8153.3-172.837.2-29000112.1
193S38.1Very low33.8Very low129 Ų129133.3 Ų133.390%0.90281%0.81SS**  trans-149.3121.8159.8-70.70000110
194A34.1Very low33.6Very low89 Ų89132.4 Ų132.474%0.73681%0.809SS**  trans-68.4153.2-177.400000112.9
195F33.2Very low33.6Very low214 Ų214133.7 Ų133.794%0.93981%0.806SS**  trans-155.7136.5131.4-103.4-75.5000110.4
196L34.3Very low33.7Very low159 Ų159138.2 Ų138.283%0.83281%0.806SS**  trans-64.5147.1-178-64.4151.3000112
197S30.4Very low34.6Very low122 Ų122139.5 Ų139.585%0.85380%0.799SS**  -176.4134.3124.2-80.80000113.1
198T32.9Very low35.2Very low132 Ų132136.6 Ų136.681%0.8180%0.796SS**  trans-61.2141.6172.546.30000113.8
199S32.8Very low35.6Very low123 Ų123136.4 Ų136.486%0.8680%0.798SS**  167.9150122.552.30000112.4
200S31.9Very low35.5Very low110 Ų110132 Ų13277%0.76980%0.796SS**  trans-77.3140.5-170.838.20000115.6
201C31.6Very low35.5Very low123 Ų123134.6 Ų134.683%0.83180%0.8SS**  trans20.4145.3146.5-59.90000120.7
202P45.3Very low35.4Very low118 Ų118133.5 Ų133.577%0.76680%0.804SS**  -150.8164.556.738-15.8000119.5
203I33Very low34.9Very low160 Ų160133.9 Ų133.982%0.82181%0.809SS**  trans5.6124.8150.4-54.8163.3000118.3
204A29.7Very low34.9Very low93 Ų93134.1 Ų134.177%0.76981%0.807SS**  trans-160.5117.7140.100000111.5
205S32.2Very low34.8Very low104 Ų104139.6 Ų139.673%0.72782%0.815SS**  trans-78.9133.4171.5-54.30000110.9
206Y33.3Very low34.7Very low227 Ų227138.1 Ų138.189%0.8981%0.811SS**  trans-147144.9152-85.5-75.2000111.6
207P47.7Very low34.7Very low106 Ų106136.7 Ų136.769%0.68881%0.811SS**PPolyproline II helixtrans-93.2163.9-170.437.8-33.3000113.3
208P44.2Very low34.7Very low121 Ų121135.9 Ų135.979%0.78681%0.805SS**PPolyproline II helixtrans-82150.8173.132.5-32.7000112.7
209P42.6Very low34.6Very low113 Ų113134.7 Ų134.773%0.73480%0.802SS**PPolyproline II helixtrans-83.7141.6-171.732.7-33.7000113.8
210S29.9Very low34.5Very low110 Ų110133.9 Ų133.977%0.76980%0.796SS**PPolyproline II helixtrans-68.7136.2165.346.10000112.4
211Y33.3Very low34.5Very low229 Ų229136.1 Ų136.190%0.89880%0.8SS**  trans-128.8134.3158.8-94-83.8000111.3
212S30.6Very low34.6Very low115 Ų115136.8 Ų136.880%0.80480%0.8SS**  trans-81.7151.8-169.6-570000114
213S32.7Very low34.6Very low115 Ų115137.1 Ų137.180%0.80480%0.802SS**  trans-55.2162.8167-47.20000114.2
214P37.8Very low34.4Very low133 Ų133132.9 Ų132.986%0.86480%0.797SS**  trans-113.5148.7142.90.220.7000113.8
215K31.1Very low34.7Very low205 Ų205137 Ų13789%0.89181%0.806SS**  trans-57.3154.9-174.4-75.2160.9168.81750116.6
216Q31.2Very low34.8Very low183 Ų183139.5 Ų139.586%0.85581%0.81SS**  trans-68.5165.6158.8-57.7-146.1-41.500113.2
217P34Very low35.2Very low128 Ų128134.2 Ų134.283%0.83180%0.803SS**  trans-119.7151.314333.9-22.5000113.2
218S30.2Very low34.6Very low106 Ų106136 Ų13674%0.74181%0.806SS**  trans-97.9147-17649.70000114.1
219S31.5Very low34.2Very low107 Ų107137.6 Ų137.675%0.74881%0.806SS**  trans55.7120.5147.266.40000122
220S31.1Very low34.4Very low105 Ų105137.8 Ų137.873%0.73481%0.807SS**  167.7145.9102.542.80000112.8
221D30.9Very low34.3Very low157 Ų157139.3 Ų139.384%0.8481%0.807SS**  trans83124.6157.8-53.5-28.9000122.9
222V33.7Very low34.3Very low137 Ų137140 Ų14083%0.8381%0.81SS**  trans-99174.9179.8-142.80000108
223P45.8Very low34.4Very low126 Ų126139.9 Ų139.982%0.81881%0.809SS**  cis-143174.79.941.3-20.7000118
224G29.6Very low34.3Very low70 Ų70137.4 Ų137.472%0.72280%0.801SS**  trans135.5115.914200000119.3
225L35.1Very low34Very low181 Ų181141 Ų14195%0.94880%0.804SS**  trans93.8109.5153.1-55.7175.6000120.1
226L34.1Very low34.1Very low156 Ų156141.3 Ų141.382%0.81781%0.806SS**  trans-72.6160.8164.3-70.4163.4000111.4
227P43.3Very low34.1Very low115 Ų115141.8 Ų141.875%0.74781%0.808SS**  -141.7129.682.430.6-10.3000116.7
228I34.6Very low34.8Very low145 Ų145141.5 Ų141.574%0.74481%0.806SS**  41.7105125.7-47172.2000118.5
229I36.2Very low34.9Very low154 Ų154141 Ų14179%0.7981%0.808SS**  trans-123.4130.3151.5-59.1175.1000106.4
230P45.1Very low34.8Very low117 Ų117142.5 Ų142.576%0.7682%0.817SS**  trans-82.9122.7177.229.4-28.9000112.1
231D28.7Very low34.9Very low142 Ų142146.4 Ų146.476%0.75982%0.824SS**  trans-62.4141.4168.7-73.4-50.3000112.6
232Y32.6Very low35Very low243 Ų243149.5 Ų149.595%0.95382%0.823SS**  trans-144.783150.2-130.6-89.8000109.5
233S33.1Very low34.8Very low113 Ų113149 Ų14979%0.7982%0.816SS**  trans-128.1118.7164.960.30000109
234G30.8Very low34.1Very low63 Ų63151.1 Ų151.165%0.64982%0.817SS**  trans175.195.3170.700000111.1
235F31.7Very low34.4Very low208 Ų208156.3 Ų156.391%0.91282%0.822SS**  trans174.576.2134.2-99.3-71.8000109.2
236F32.8Very low35.1Very low212 Ų212153 Ų15393%0.9381%0.812SS**  trans-149.9113.5152.4-94.3-77.6000107.4
237Q31.7Very low34.9Very low193 Ų193149.6 Ų149.690%0.90281%0.806SS**  trans-124.5132.6157.2-92.5-169.7-28.100108.6
238P47.8Very low34.3Very low122 Ų122151 Ų15179%0.79281%0.812SS**  trans-103.1175.5174.838.8-30.9000112.5
239A33.9Very low34.3Very low94 Ų94151.7 Ų151.778%0.77782%0.816SS**  trans102.5113.7159.900000116.8
240C29.3Very low34.8Very low139 Ų139149.7 Ų149.794%0.93981%0.813SS**  -158.3144.9110.3-89.90000109.6
241Q33Very low34.2Very low188 Ų188151.4 Ų151.488%0.87982%0.816SS**  trans-123.5156.9-169.5-173.4154.51.400109.9
242R33Very low34.5Very low221 Ų221155.5 Ų155.583%0.83482%0.821SS**  trans110.3136173.8-74.8-170159.7151.7-0.1113.7
243D28.8Very low34.5Very low127 Ų127153.5 Ų153.568%0.67982%0.817SS**  cis-160.31543.2-91.2-39.8000109.3
244M31.3Very low34.7Very low171 Ų171153.4 Ų153.484%0.84281%0.814SS**  trans40.8128.2147.9-61.9-82.694.800124.1
245H34.6Very low34.7Very low178 Ų178160.5 Ų160.582%0.82483%0.827SS**  trans-55.4-176.4171.3-84.8-83.7000117.7
246P50.3Low34.9Very low113 Ų113156.3 Ų156.373%0.73482%0.818SS**  cis-134.2172-34.734.7-16.7000113.6
247A29.9Very low35Very low84 Ų84151.9 Ų151.969%0.69481%0.811SS**  trans148.5140.9135.800000115.4
248T30.3Very low35Very low143 Ų143148.3 Ų148.388%0.87781%0.806SS**  trans72122.4149.539.10000122.1
249I35.9Very low34.5Very low161 Ų161148.2 Ų148.283%0.82681%0.805SS**  trans-72.9153.6166.8-46.6169.5000107.3
250P46.8Very low34.4Very low112 Ų112151.9 Ų151.973%0.72781%0.811SS**  cis-151.2175.541.539.9-16.4000119.8
251D31Very low34.4Very low152 Ų152152 Ų15281%0.81380%0.802SS**  trans108.2135.9137.1-118.3-26.1000121.8
252R36.3Very low34.7Very low229 Ų229149.5 Ų149.586%0.86480%0.8SS**  trans-77.8145.5-170.8-71.4170.7159.8-172.2-5112.3
253K32.7Very low34.6Very low201 Ų201148 Ų14887%0.87480%0.8SS**  trans-171.6163.8135.6-103.4168.5-173.2-179.90111
254P37.3Very low35Very low111 Ų111153.2 Ų153.272%0.72181%0.81SS**PPolyproline II helix-92.9145.8-129.535.4-35.9000114.1
255F30.6Very low35.2Very low212 Ų212151.2 Ų151.293%0.9381%0.807SS**PPolyproline II helixtrans-78.7121.6167.2-96.4-90.6000110.6
256V36.4Very low35.4Very low119 Ų119147.9 Ų147.972%0.72180%0.801SS**PPolyproline II helixtrans-66133.5164179.10000108.5C258V256-C258 PolarHBondContact O-N 3.47Å
257P34.6Very low35.1Very low120 Ų120148 Ų14878%0.77980%0.802SS**PPolyproline II helixtrans-79.8120.7174.830-29.3000110.1
258C31.6Very low35.4Very low117 Ų117149.6 Ų149.679%0.79181%0.805SS**PPolyproline II helixtrans-77.7151.9165.4-79.60000110.7V256V256-C258 PolarHBondContact O-N 3.47Å
259P36.7Very low35.7Very low121 Ų121151.1 Ų151.179%0.78681%0.807SS**PPolyproline II helixtrans-75.6149.6-154.929.1-35.1000114.4D261P259-D261 PolarHBondContact O-N 3.24Å
260L32.9Very low35.9Very low170 Ų170149.5 Ų149.589%0.8981%0.805SS**PPolyproline II helixtrans-60.4123.4172.7-83.995.4000111.1
261D29.1Very low35.3Very low142 Ų142149.8 Ų149.876%0.75981%0.807SS**PPolyproline II helixtrans-69.7131.2159.1-106.9-41.2000110.2P259 F263P259-D261 PolarHBondContact O-N 3.24Å; D261-F263 PolarHBondContact O-N 2.77Å; D261-F263 VanDerWaalsContact O-N 3.07Å
262T37.8Very low35.3Very low136 Ų136150.2 Ų150.283%0.83481%0.808SS**  trans-73.895.1-177.4-580000109.2R264T262-R264 PolarHBondContact O-N 2.94Å
263F32.3Very low35.1Very low189 Ų189146.5 Ų146.583%0.82981%0.805SS**  trans-79.5111171.7-92.5-83.8000111.6D261 V265D261-F263 PolarHBondContact O-N 2.77Å; D261-F263 VanDerWaalsContact O-N 3.07Å; F263-V265 PolarHBondContact O-N 3.36Å
264R35.8Very low35.1Very low237 Ų237142.6 Ų142.689%0.89480%0.799SS**PPolyproline II helixtrans-48.1120.2168.8-153.5172.1-176.2-178.90.8111.5T262T262-R264 PolarHBondContact O-N 2.94Å
265V35.6Very low35.2Very low129 Ų129144.1 Ų144.178%0.78280%0.799SS**PPolyproline II helixtrans-67.1130.2172178.20000109.7F263F263-V265 PolarHBondContact O-N 3.36Å
266P39.5Very low35.6Very low107 Ų107145.2 Ų145.270%0.69580%0.797SS**PPolyproline II helixtrans-78.2144167.730.7-30.3000110.5
267P44.1Very low35.5Very low115 Ų115146 Ų14675%0.74780%0.798SS**PPolyproline II helixtrans-72.7151.3-176.129.5-34000112.5
268P35.3Very low35.4Very low119 Ų119150 Ų15077%0.77380%0.803SS**PPolyproline II helixtrans-75.7133.817530-32.2000111.5T270P268-T270 PolarHBondContact O-N 3.49Å
269L36.6Very low35.4Very low175 Ų175150.5 Ų150.592%0.91680%0.803SS**PPolyproline II helixtrans-71.6116.2172.3-66.5170.4000110.2
270T40.4Very low35.5Very low126 Ų126152.8 Ų152.877%0.77381%0.807SS**PPolyproline II helixtrans-81142170.949.30000111.4P268P268-T270 PolarHBondContact O-N 3.49Å
271P34.8Very low35.3Very low119 Ų119148.2 Ų148.277%0.77380%0.801SS**PPolyproline II helixtrans-76.6129.7175.529.2-31.1000112N273P271-N273 PolarHBondContact O-N 3.03Å
272L32Very low35.5Very low161 Ų161146.2 Ų146.284%0.84381%0.805SS**  trans-65.895.7171.5-92.8159.6000111T274L272-T274 PolarHBondContact O-N 3.02Å
273N30.1Very low35.7Very low150 Ų150146.1 Ų146.180%0.80281%0.806SS**  trans-82.495.9155.2-90.9-18.9000108.2P271 I275P271-N273 PolarHBondContact O-N 3.03Å; N273-I275 PolarHBondContact O-N 3.19Å
274T34.8Very low35.7Very low120 Ų120141 Ų14174%0.73681%0.806SS**  trans-76105.6165.5-55.80000108.1L272 R276L272-T274 PolarHBondContact O-N 3.02Å; T274-R276 PolarHBondContact O-N 3.38Å
275I38.2Very low35.5Very low142 Ų142133.6 Ų133.673%0.72880%0.804SS**  trans-52.1114.4167.3-65.6162000108.3N273 N277N273-I275 PolarHBondContact O-N 3.19Å; I275-N277 PolarHBondContact O-N 3.24Å
276R38.2Very low35.3Very low235 Ų235131.7 Ų131.789%0.88781%0.811SS**  trans-76.6115.4160.2-85.9-176.4174176.7-1.8107.3T274 F278T274-R276 PolarHBondContact O-N 3.38Å; R276-F278 PolarHBondContact O-N 3.42Å
277N35.7Very low34.8Very low137 Ų137130.3 Ų130.373%0.73382%0.816SS**  trans-55.9122.6171.8-68.9-23.5000110.2I275I275-N277 PolarHBondContact O-N 3.24Å
278F32.5Very low34.3Very low203 Ų203129.8 Ų129.889%0.8982%0.815SS**  trans-76.1117158.2-89.8-93.7000107.8R276R276-F278 PolarHBondContact O-N 3.42Å
279T32.3Very low34.1Very low128 Ų128132.4 Ų132.479%0.78582%0.817SS**  trans-14386.6161.2-38.40000107.1
280L36.8Very low34Very low168 Ų168130.9 Ų130.988%0.8882%0.815SS**  trans-117.5110.1161.1-81.6170.4000106.2
281G29.3Very low33.7Very low74 Ų74128.7 Ų128.776%0.76382%0.818SS**PPolyproline II helixtrans-65.4141176.400000111.3
282A32.7Very low33.7Very low101 Ų101131.9 Ų131.984%0.83582%0.823SS**PPolyproline II helixtrans-79.4141.5160.100000109.1
283P42.7Very low34.3Very low133 Ų133129.3 Ų129.386%0.86482%0.815SS**PPolyproline II helixtrans-92.3142.2168.834.3-27.6000110.5
284G31.6Very low34.5Very low81 Ų81132 Ų13284%0.83581%0.814SS**  trans-127.1132.9165.800000110.3
285G32.5Very low34.2Very low83 Ų83132.8 Ų132.886%0.85681%0.813SS**  trans99.8104.2148.600000118.7
286G31.2Very low33.9Very low89 Ų89131.2 Ų131.292%0.91882%0.815SS**  78.9122.4125.100000119.8
287G29.4Very low33.5Very low78 Ų78125.2 Ų125.280%0.80481%0.809SS**  trans158.6104.8162.500000113
288S32.9Very low33.5Very low104 Ų104122.8 Ų122.873%0.72781%0.808SS**  trans-56.1147.9169.944.70000113
289E32Very low33.5Very low174 Ų174124 Ų12481%0.81381%0.808SS**  171.1112.4125.9-88.7158.8-163.700111.8
290T34.8Very low33.7Very low142 Ų142123 Ų12387%0.87181%0.807SS**  trans23.8123.3141.753.50000120.5
291G32.8Very low34.1Very low81 Ų81119.3 Ų119.384%0.83579%0.792SS**  trans154.982.3153.100000115.9
292Q35.2Very low34.8Very low186 Ų186123.7 Ų123.787%0.86979%0.793SS**  trans-81.8156.1148.3-101.1-165.4-1000108.2
293P45.5Very low35.2Very low106 Ų106126.1 Ų126.169%0.68879%0.792SS**  -153.9162.355.838.6-15.8000120
294R32.8Very low35Very low207 Ų207127.9 Ų127.978%0.78179%0.793SS**  trans75.1126.1133.4-80.1173.8-176.5-110.31.6123
295L29.9Very low35.4Very low137 Ų137129.6 Ų129.672%0.71779%0.79SS**  62.5133.7126.6-61.4165.7000116.3
296S31.2Very low35.8Very low109 Ų109134 Ų13476%0.76279%0.793SS**  cis-167.1164.725.8-32.90000103.8
297S30.4Very low36.4Very low109 Ų109141 Ų14176%0.76279%0.791SS**  -178.5140.651.4-177.90000106.8
298A35.3Very low36.9Very low86 Ų86142.8 Ų142.871%0.71179%0.789SS**  trans-60.4140.8167.400000111.4
299Y32.2Very low37.7Very low228 Ų228145.6 Ų145.689%0.89479%0.794SS**  trans-146.6107.6144.2-122.3-89.3000107.8
300S37.5Very low38.4Very low108 Ų108145 Ų14576%0.75580%0.796SS**  trans-117.4140.1153.4-1480000103.9
301P45Very low38.9Very low89 Ų89149.2 Ų149.258%0.57880%0.796SS**  -153.6156.273.232-8.7000116.9
302Q42.8Very low39.3Very low167 Ų167151.3 Ų151.378%0.7880%0.795SS**  trans55.7105.3134.4-58.3169.23100119.5
303N40.7Very low39.7Very low152 Ų152152.2 Ų152.281%0.81379%0.79SS**  160.3101.2125.3-94.9-74.2000110.1
304L39.3Very low39.9Very low169 Ų169156.3 Ų156.389%0.88580%0.797SS**  trans-139.9132.7156.2-84.7107.1000110.1
305P41Very low40.2Very low118 Ų118155.6 Ų155.677%0.76680%0.796SS**  trans-75.1142.2-171.730.4-33.7000111.5R307P305-R307 PolarHBondContact O-N 3.33Å; P305-R307 VanDerWaalsContact O-N 3.1Å
306L40.4Very low40.9Very low176 Ų176154.9 Ų154.992%0.92180%0.799SS**  trans-53.3112.2171.4-70.8161.3000110
307R42.5Very low41.6Very low234 Ų234156.9 Ų156.988%0.88380%0.801SS**  trans-68.7133.1168-71.2-175.6172.7-150.9-1.1108.7P305 I309P305-R307 PolarHBondContact O-N 3.33Å; P305-R307 VanDerWaalsContact O-N 3.1Å; R307-I309 PolarHBondContact O-N 3.5Å
308P41.4Very low42.3Very low116 Ų116161.8 Ų161.875%0.75380%0.803SS**  trans-63.2128.3175-1729.2000109.9L310P308-L310 PolarHBondContact O-N 3.45Å
309I49.2Very low42.7Very low164 Ų164163.6 Ų163.684%0.84181%0.807SS**  trans-61.2101.2170.9-60.5168.2000107.2R307 R311R307-I309 PolarHBondContact O-N 3.5Å; I309-R311 PolarHBondContact O-N 3.49Å; I309-R311 VanDerWaalsContact O-N 3.16Å
310L45.7Very low43.2Very low162 Ų162157.6 Ų157.685%0.84880%0.799SS**  trans-63.6115.4168.6-72.4172.3000107.5P308P308-L310 PolarHBondContact O-N 3.45Å
311R45.1Very low44.5Very low230 Ų230161.8 Ų161.887%0.86880%0.804SS**PPolyproline II helixtrans-50.1132.2169-66.4-177.3-174-158.40.9108.6I309 R313I309-R311 PolarHBondContact O-N 3.49Å; I309-R311 VanDerWaalsContact O-N 3.16Å; R311-R313 PolarHBondContact O-N 3.41Å; R311-R313 VanDerWaalsContact O-N 3.09Å
312P41.7Very low44.2Very low125 Ų125164.3 Ų164.381%0.81282%0.817SS**PPolyproline II helixtrans-56.4121.2178.2-23.832.6000110.2K314P312-K314 PolarHBondContact O-N 2.95Å
313R44.3Very low44.6Very low205 Ų205161.8 Ų161.877%0.77482%0.815SS**PPolyproline II helixtrans-57.7121.3170.7-117.2-179.9164.9-178.2-1.7107.5R311 Y315R311-R313 PolarHBondContact O-N 3.41Å; R311-R313 VanDerWaalsContact O-N 3.09Å; R313-Y315 PolarHBondContact O-N 3.16Å
314K50.1Low45Very low191 Ų191160.6 Ų160.683%0.8381%0.813SS**SBendtrans-62.45.6-175.7-139.2173.9-175.3-1790115.4P312P312-K314 PolarHBondContact O-N 2.95Å
315Y38.2Very low46.1Very low193 Ų193158.8 Ų158.876%0.75780%0.8SS**  trans-153.6107.6173.1-66.4-79.2000109.8R313 N317R313-Y315 PolarHBondContact O-N 3.16Å; Y315-N317 VanDerWaalsContact C-N 3.35Å; Y315-N317 PolarHBondContact O-N 3.49Å
316P45.8Very low47.6Very low121 Ų121160.5 Ų160.579%0.78680%0.798SS**SBendtrans-78-6.7-172.9-14.129.1000115.8
317N44.9Very low49.8Very low151 Ų151156.9 Ų156.981%0.80777%0.772SS**  trans-126.179.8-176.8-81.8-48.1000112.1Y315Y315-N317 VanDerWaalsContact C-N 3.35Å; Y315-N317 PolarHBondContact O-N 3.49Å
318R45.1Very low52Low213 Ų213149 Ų14980%0.80475%0.751SS**  trans-112.4100.9151.3-169.5178.8-166.8-163.34.1106.7S320R318-S320 PolarHBondContact O-N 2.97Å
319P44.8Very low54.4Low123 Ų123148 Ų14880%0.79973%0.733SS**  trans-57.6109.9174.8-21.531.8000109.1
320S42.3Very low56.4Low103 Ų103143.5 Ų143.572%0.7272%0.715SS**  trans-92.2104.7174.948.50000108.8R318R318-S320 PolarHBondContact O-N 2.97Å
321K63.4Low58.7Low196 Ų196136.5 Ų136.585%0.85268%0.679SS**  trans31.7107.6153-64.7179.1178.3-178.80117.5
322T38.8Very low60.9Low141 Ų141130.1 Ų130.187%0.86567%0.668SS**  -170.8176.112348.50000108
323P52.2Low63.3Low114 Ų114125.7 Ų125.774%0.7464%0.641SS**SBend-95.1168.3-82.635.8-20.9000112.9
324V49.8Very low65.4Low127 Ų127124.9 Ų124.977%0.7765%0.646SS**  trans79113.4-166.9-165.60000111.7E326V324-E326 PolarHBondContact O-N 3.34Å
325H62.2Low67.3Low132 Ų132119.8 Ų119.861%0.61165%0.648SS**  trans-66.872168.4-176.8-55.2000107.6R327H325-R327 WeakPolarHBondContact CE1-CD 3.03Å; H325-R327 WeakPolarHBondContact CE1-CG 3.43Å; H325-R327 PolarHBondContact CE1-NE 3.5Å; H325-R327 VanDerWaalsContact ND1-CD 3.31Å; H325-R327 WeakPolarHBondContact ND1-CD 3.49Å; H325-R327 WeakPolarHBondContact ND1-CG 3.25Å; H325-R327 PolarHBondContact O-N 2.86Å; H325-R327 VanDerWaalsContact O-N 3.17Å
326E72.8Confident69.8Low153 Ų153111.6 Ų111.672%0.71562%0.619SS**  trans-63.6123.6176.6-125.1175.5176.900107.1V324 P328V324-E326 PolarHBondContact O-N 3.34Å; E326-P328 VanDerWaalsContact C-CD 3.44Å; E326-P328 HydrophobicContact CB-CG 4.49Å; E326-P328 WeakPolarHBondContact O-CD 3.4Å
327R86.3Confident72Confident101 Ų101113.4 Ų113.438%0.38162%0.622SS.*  trans-114.777.7175.6-61.5177.887.9151.1-9.8106.2H325 Y329 R339 F340H325-R327 WeakPolarHBondContact CE1-CD 3.03Å; H325-R327 WeakPolarHBondContact CE1-CG 3.43Å; H325-R327 PolarHBondContact CE1-NE 3.5Å; H325-R327 VanDerWaalsContact ND1-CD 3.31Å; H325-R327 WeakPolarHBondContact ND1-CD 3.49Å; H325-R327 WeakPolarHBondContact ND1-CG 3.25Å; H325-R327 PolarHBondContact O-N 2.86Å; H325-R327 VanDerWaalsContact O-N 3.17Å; R327-Y329 PolarHBondContact O-N 3.37Å; R327-Y329 VanDerWaalsContact O-N 3.08Å; R327-R339 HydrophobicContact CB-CB 3.43Å; R327-R339 VanDerWaalsContact CB-CB 3.43Å; R327-R339 HydrophobicContact CG-CB 4.34Å; R327-R339 PolarHBondContact NE-O 3.07Å; R327-R339 PolarHBondContact NH2-O 2.88Å; R327-R339 PolarHBondContact O-NE 3.32Å; R327-R339 VanDerWaalsContact O-NE 3.13Å; R327-R339 PolarHBondContact O-NH2 3.29Å; R327-F340 CarbonylContact C-O 3.57Å; R327-F340 WeakPolarHBondContact CA-O 3.26Å; R327-F340 WeakPolarHBondContact CB-O 3.44Å
328P87.7Confident74.2Confident69 Ų69113.1 Ų113.145%0.44861%0.609SS.*  trans-66.5-15.4-170.1-19.734.7000112.4E326 P330E326-P328 VanDerWaalsContact C-CD 3.44Å; E326-P328 HydrophobicContact CB-CG 4.49Å; E326-P328 WeakPolarHBondContact O-CD 3.4Å; P328-P330 WeakPolarHBondContact O-CD 3.39Å
329Y91.3Very high76.5Confident94 Ų94109.2 Ų109.237%0.36960%0.595SS.*EExtended strand (participates in β ladder)trans-105.284.7-172.5-56.5-75000111.7R327 R339 F340 S341R327-Y329 PolarHBondContact O-N 3.37Å; R327-Y329 VanDerWaalsContact O-N 3.08Å; Y329-R339 CarbonylContact O-C 3.51Å; Y329-R339 WeakPolarHBondContact O-CA 3.39Å; Y329-F340 WeakPolarHBondContact CB-O 3.41Å; Y329-F340 WeakPolarHBondContact CD2-O 3.07Å; Y329-F340 PolarHBondContact N-O 3.03Å; Y329-F340 VanDerWaalsContact N-O 3.14Å; Y329-F340 PolarHBondContact O-N 2.67Å; Y329-S341 WeakPolarHBondContact CE2-O 3.49Å
330P91.3Very high78.8Confident70 Ų70104.5 Ų104.546%0.45556%0.561SS.*EExtended strand (participates in β ladder)trans-68.8151.117231-35.4000111.8P328 R339 L346P328-P330 WeakPolarHBondContact O-CD 3.39Å; P330-R339 HydrophobicContact CB-CG 4.14Å; P330-L346 WeakPolarHBondContact O-CD1 3.3Å; P330-L346 WeakPolarHBondContact O-CD2 3.49Å
331C95.1Very high81.2Confident14 Ų14102.1 Ų102.110%0.09555%0.545CS..  trans-72128.5169.6-174.60000109.8A333 C336 R338 L346 H349 H353C331-A333 VanDerWaalsContact C-N 3.26Å; C331-A333 PolarHBondContact O-N 3.44Å; C331-C336 HydrophobicContact CB-CB 4.2Å; C331-R338 WeakPolarHBondContact CB-O 3.46Å; C331-R338 PolarHBondContact N-O 3.12Å; C331-L346 HydrophobicContact CB-CD1 4.27Å; C331-H349 VanDerWaalsContact SG-CD2 3.57Å; C331-H349 PolarHBondContact SG-NE2 3.46Å; C331-H349 VanDerWaalsContact SG-NE2 3.44Å; C331-H353 VanDerWaalsContact SG-CD2 3.56Å; C331-H353 PolarHBondContact SG-NE2 2.94Å
332P91.1Very high82.5Confident97 Ų9799.2 Ų99.263%0.6353%0.529SS*.  trans-82.31.1178.833.1-36000113.7I350P332-I350 HydrophobicContact CG-CD1 4.25Å
333A91Very high85Confident32 Ų3295.6 Ų95.626%0.26451%0.509SS..SBendtrans-81.2131.6-178.600000111.2C331 G335 C336 H353C331-A333 VanDerWaalsContact C-N 3.26Å; C331-A333 PolarHBondContact O-N 3.44Å; A333-G335 PolarHBondContact O-N 3.1Å; A333-C336 HydrophobicContact CB-CB 4.18Å; A333-C336 WeakPolarHBondContact O-CB 3.36Å; A333-C336 PolarHBondContact O-N 2.8Å; A333-H353 HydrophobicContact CB-CB 4.45Å; A333-H353 VanDerWaalsContact CB-CD2 3.41Å; A333-H353 WeakPolarHBondContact CB-CD2 3.42Å
334E88.9Confident86.8Confident188 Ų18892.5 Ų92.588%0.87949%0.486SS*.THydrogen-bonded Turntrans-54.8131.3174.9-61.8-55.7137.500111.1C336E334-C336 VanDerWaalsContact C-N 3.35Å
335G89.4Confident88.8Confident84 Ų8489.1 Ų89.187%0.86646%0.462SS*.THydrogen-bonded Turntrans76.114.7-176.600000115.2A333A333-G335 PolarHBondContact O-N 3.1Å
336C92.1Very high90.3Very high20 Ų2084 Ų8414%0.13544%0.439CS..  trans-119.8101.2176.8-164.60000113.9C331 A333 E334 R338 H349 H353C331-C336 HydrophobicContact CB-CB 4.2Å; A333-C336 HydrophobicContact CB-CB 4.18Å; A333-C336 WeakPolarHBondContact O-CB 3.36Å; A333-C336 PolarHBondContact O-N 2.8Å; E334-C336 VanDerWaalsContact C-N 3.35Å; C336-R338 PolarHBondContact O-N 3.26Å; C336-R338 VanDerWaalsContact O-N 3.1Å; C336-H349 PolarHBondContact SG-NE2 3.09Å; C336-H353 PolarHBondContact SG-NE2 3.39Å
337D90.9Very high91.2Very high159 Ų15980.3 Ų80.385%0.8543%0.427SS*.  trans-80.712.8-179.5-55.5-40.6000114.5R339D337-R339 PolarHBondContact O-N 2.98Å
338R91.1Very high91.4Very high146 Ų14679.7 Ų79.755%0.55143%0.425SS*.  trans-78.7123.3-175.5-70.6-173.6178-178.74.2110.9C331 C336 F340C331-R338 WeakPolarHBondContact CB-O 3.46Å; C331-R338 PolarHBondContact N-O 3.12Å; C336-R338 PolarHBondContact O-N 3.26Å; C336-R338 VanDerWaalsContact O-N 3.1Å; R338-F340 HydrophobicContact CB-CE2 3.87Å; R338-F340 HydrophobicContact CB-CZ 3.84Å
339R94.1Very high91.7Very high131 Ų13177 Ų7749%0.49441%0.406SS..EExtended strand (participates in β ladder)trans-105.8158.1170.3-51.2-175.667-179.43.4110.5R327 Y329 P330 D337R327-R339 HydrophobicContact CB-CB 3.43Å; R327-R339 VanDerWaalsContact CB-CB 3.43Å; R327-R339 HydrophobicContact CG-CB 4.34Å; R327-R339 PolarHBondContact NE-O 3.07Å; R327-R339 PolarHBondContact NH2-O 2.88Å; R327-R339 PolarHBondContact O-NE 3.32Å; R327-R339 VanDerWaalsContact O-NE 3.13Å; R327-R339 PolarHBondContact O-NH2 3.29Å; Y329-R339 CarbonylContact O-C 3.51Å; Y329-R339 WeakPolarHBondContact O-CA 3.39Å; P330-R339 HydrophobicContact CB-CG 4.14Å; D337-R339 PolarHBondContact O-N 2.98Å
340F92.8Very high91.7Very high23 Ų2375 Ų7510%0.10140%0.401CS..EExtended strand (participates in β ladder)trans-132151.4-179.2-60.9-85000111.2R327 Y329 R338 E345 L346 H349R327-F340 CarbonylContact C-O 3.57Å; R327-F340 WeakPolarHBondContact CA-O 3.26Å; R327-F340 WeakPolarHBondContact CB-O 3.44Å; Y329-F340 WeakPolarHBondContact CB-O 3.41Å; Y329-F340 WeakPolarHBondContact CD2-O 3.07Å; Y329-F340 PolarHBondContact N-O 3.03Å; Y329-F340 VanDerWaalsContact N-O 3.14Å; Y329-F340 PolarHBondContact O-N 2.67Å; R338-F340 HydrophobicContact CB-CE2 3.87Å; R338-F340 HydrophobicContact CB-CZ 3.84Å; F340-E345 HydrophobicContact CB-CB 3.98Å; F340-E345 HydrophobicContact CD1-CB 3.68Å; F340-E345 HydrophobicContact CG-CB 4.06Å; F340-L346 HydrophobicContact CB-CB 4.18Å; F340-L346 HydrophobicContact CD2-CB 3.82Å; F340-L346 HydrophobicContact CD2-CD1 3.79Å; F340-L346 HydrophobicContact CD2-CG 4.42Å; F340-L346 HydrophobicContact CE2-CD1 4.06Å; F340-L346 HydrophobicContact CG-CB 4.18Å; F340-H349 HydrophobicContact CE1-CB 3.92Å; F340-H349 HydrophobicContact CE2-CB 3.64Å; F340-H349 AromaticContact CE2-CD2 3.27Å; F340-H349 WeakPolarHBondContact CE2-CD2 3.45Å; F340-H349 AromaticContact CE2-CG 3.49Å; F340-H349 VanDerWaalsContact CE2-CG 3.49Å; F340-H349 HydrophobicContact CZ-CB 3.29Å; F340-H349 AromaticContact CZ-CD2 3.43Å; F340-H349 VanDerWaalsContact CZ-CD2 3.43Å; F340-H349 WeakPolarHBondContact CZ-CD2 3.37Å; F340-H349 AromaticContact CZ-CG 3.16Å; F340-H349 AromaticContact CZ-ND1 3.78Å
341S92.8Very high91.8Very high53 Ų5374.8 Ų74.837%0.37139%0.391SS..SBendtrans-80.6-23.3177.8670000112Y329 E345Y329-S341 WeakPolarHBondContact CE2-O 3.49Å; S341-E345 PolarHBondContact OG-OE2 2.75Å; S341-E345 VanDerWaalsContact OG-OE2 3.13Å
342R91.1Very high91.6Very high136 Ų13679.3 Ų79.351%0.51341%0.414SS..SBendtrans-130.9146.5-177.1-61.8167.450.81620.6111.1D344 E345 L346R342-D344 VanDerWaalsContact C-N 3.34Å; R342-D344 VanDerWaalsContact CB-OD1 3.26Å; R342-D344 WeakPolarHBondContact CB-OD1 3.32Å; R342-D344 IonicContact CZ-OD1 3.76Å; R342-D344 IonicContact CZ-OD2 3.93Å; R342-D344 IonicContact NE-OD1 3.85Å; R342-D344 PolarHBondContact NE-OD1 3.5Å; R342-D344 IonicContact NE-OD2 2.82Å; R342-D344 VanDerWaalsContact NH2-CG 3.28Å; R342-D344 IonicContact NH2-OD1 3.24Å; R342-D344 PolarHBondContact NH2-OD1 3.21Å; R342-D344 IonicContact NH2-OD2 3.18Å; R342-D344 PolarHBondContact NH2-OD2 3.39Å; R342-D344 PolarHBondContact O-N 2.99Å; R342-E345 HydrophobicContact CB-CB 4.46Å; R342-E345 HydrophobicContact CB-CG 4.06Å; R342-E345 WeakPolarHBondContact O-CB 3.43Å; R342-E345 PolarHBondContact O-N 3.39Å; R342-L346 PolarHBondContact O-N 3.45Å
343S91.1Very high91.6Very high64 Ų6478.8 Ų78.845%0.44840%0.403SS..Hα-helixtrans-61.8-39.317756.40000112.5E345 L346 T347S343-E345 VanDerWaalsContact C-N 3.27Å; S343-E345 PolarHBondContact O-N 3.06Å; S343-L346 WeakPolarHBondContact O-CB 3.36Å; S343-L346 PolarHBondContact O-N 3.24Å; S343-L346 VanDerWaalsContact O-N 3.16Å; S343-T347 PolarHBondContact O-N 3.42Å; S343-T347 PolarHBondContact O-OG1 2.89Å; S343-T347 VanDerWaalsContact O-OG1 3.09Å
344D89.9Confident91.5Very high50 Ų5081.7 Ų81.727%0.26742%0.417SS..Hα-helixtrans-66.2-28.9179.370.2-78.7000113.2R342 R348R342-D344 VanDerWaalsContact C-N 3.34Å; R342-D344 VanDerWaalsContact CB-OD1 3.26Å; R342-D344 WeakPolarHBondContact CB-OD1 3.32Å; R342-D344 IonicContact CZ-OD1 3.76Å; R342-D344 IonicContact CZ-OD2 3.93Å; R342-D344 IonicContact NE-OD1 3.85Å; R342-D344 PolarHBondContact NE-OD1 3.5Å; R342-D344 IonicContact NE-OD2 2.82Å; R342-D344 VanDerWaalsContact NH2-CG 3.28Å; R342-D344 IonicContact NH2-OD1 3.24Å; R342-D344 PolarHBondContact NH2-OD1 3.21Å; R342-D344 IonicContact NH2-OD2 3.18Å; R342-D344 PolarHBondContact NH2-OD2 3.39Å; R342-D344 PolarHBondContact O-N 2.99Å; D344-R348 VanDerWaalsContact O-CB 3.26Å; D344-R348 WeakPolarHBondContact O-CB 3.48Å; D344-R348 PolarHBondContact O-N 2.82Å; D344-R348 IonicContact OD2-CZ 3.43Å; D344-R348 IonicContact OD2-NH1 2.93Å; D344-R348 IonicContact OD2-NH2 3.48Å; D344-R348 PolarHBondContact OD2-NH2 3Å
345E92.3Very high91.5Very high56 Ų5674.9 Ų74.926%0.26240%0.397SS..Hα-helixtrans-70.4-42.5173.4-66174.7171.400111.2F340 S341 R342 S343 R348 H349F340-E345 HydrophobicContact CB-CB 3.98Å; F340-E345 HydrophobicContact CD1-CB 3.68Å; F340-E345 HydrophobicContact CG-CB 4.06Å; S341-E345 PolarHBondContact OG-OE2 2.75Å; S341-E345 VanDerWaalsContact OG-OE2 3.13Å; R342-E345 HydrophobicContact CB-CB 4.46Å; R342-E345 HydrophobicContact CB-CG 4.06Å; R342-E345 WeakPolarHBondContact O-CB 3.43Å; R342-E345 PolarHBondContact O-N 3.39Å; S343-E345 VanDerWaalsContact C-N 3.27Å; S343-E345 PolarHBondContact O-N 3.06Å; E345-R348 PolarHBondContact O-N 3.34Å; E345-H349 VanDerWaalsContact O-CB 3.31Å; E345-H349 WeakPolarHBondContact O-CB 3.29Å; E345-H349 PolarHBondContact O-N 3.46Å
346L93.6Very high91.6Very high25 Ų2575.9 Ų75.913%0.13138%0.379CS..Hα-helixtrans-61.8-50.1173172.462.1000111P330 C331 F340 R342 S343 R348 H349 I350P330-L346 WeakPolarHBondContact O-CD1 3.3Å; P330-L346 WeakPolarHBondContact O-CD2 3.49Å; C331-L346 HydrophobicContact CB-CD1 4.27Å; F340-L346 HydrophobicContact CB-CB 4.18Å; F340-L346 HydrophobicContact CD2-CB 3.82Å; F340-L346 HydrophobicContact CD2-CD1 3.79Å; F340-L346 HydrophobicContact CD2-CG 4.42Å; F340-L346 HydrophobicContact CE2-CD1 4.06Å; F340-L346 HydrophobicContact CG-CB 4.18Å; R342-L346 PolarHBondContact O-N 3.45Å; S343-L346 WeakPolarHBondContact O-CB 3.36Å; S343-L346 PolarHBondContact O-N 3.24Å; S343-L346 VanDerWaalsContact O-N 3.16Å; L346-R348 VanDerWaalsContact C-N 3.26Å; L346-R348 PolarHBondContact O-N 3.05Å; L346-H349 CarbonylContact O-C 3.42Å; L346-H349 WeakPolarHBondContact O-CA 3.3Å; L346-H349 WeakPolarHBondContact O-CB 3.25Å; L346-H349 PolarHBondContact O-N 2.93Å; L346-I350 HydrophobicContact CD1-CD1 3.87Å; L346-I350 HydrophobicContact CD1-CG1 3.94Å; L346-I350 HydrophobicContact CD2-CD1 4.46Å; L346-I350 HydrophobicContact CG-CD1 3.82Å; L346-I350 HydrophobicContact CG-CG1 4.35Å; L346-I350 WeakPolarHBondContact O-CG1 3.22Å; L346-I350 PolarHBondContact O-N 3.31Å
347T91.1Very high91.7Very high75 Ų7580.4 Ų80.446%0.4640%0.396SS..Hα-helixtrans-58.2-40.4178.5-54.20000111.7S343 H349S343-T347 PolarHBondContact O-N 3.42Å; S343-T347 PolarHBondContact O-OG1 2.89Å; S343-T347 VanDerWaalsContact O-OG1 3.09Å; T347-H349 VanDerWaalsContact C-N 3.35Å
348R91.5Very high91.6Very high88 Ų8875.7 Ų75.733%0.33238%0.375SS..Hα-helixtrans-66.9-37.9175.2-171.2-173-52.3108.69.6111.8D344 E345 L346 R351 R370D344-R348 VanDerWaalsContact O-CB 3.26Å; D344-R348 WeakPolarHBondContact O-CB 3.48Å; D344-R348 PolarHBondContact O-N 2.82Å; D344-R348 IonicContact OD2-CZ 3.43Å; D344-R348 IonicContact OD2-NH1 2.93Å; D344-R348 IonicContact OD2-NH2 3.48Å; D344-R348 PolarHBondContact OD2-NH2 3Å; E345-R348 PolarHBondContact O-N 3.34Å; L346-R348 VanDerWaalsContact C-N 3.26Å; L346-R348 PolarHBondContact O-N 3.05Å; R348-R351 WeakPolarHBondContact O-CB 3.31Å; R348-R351 PolarHBondContact O-N 3.41Å; R348-R370 HydrophobicContact CG-CG 4.05Å
349H92.7Very high91.8Very high11 Ų1171.7 Ų71.75%0.05136%0.362CS..Hα-helixtrans-67.4-42177.4172.259.9000112.4C331 C336 F340 E345 L346 T347 R351 I352 H353C331-H349 VanDerWaalsContact SG-CD2 3.57Å; C331-H349 PolarHBondContact SG-NE2 3.46Å; C331-H349 VanDerWaalsContact SG-NE2 3.44Å; C336-H349 PolarHBondContact SG-NE2 3.09Å; F340-H349 HydrophobicContact CE1-CB 3.92Å; F340-H349 HydrophobicContact CE2-CB 3.64Å; F340-H349 AromaticContact CE2-CD2 3.27Å; F340-H349 WeakPolarHBondContact CE2-CD2 3.45Å; F340-H349 AromaticContact CE2-CG 3.49Å; F340-H349 VanDerWaalsContact CE2-CG 3.49Å; F340-H349 HydrophobicContact CZ-CB 3.29Å; F340-H349 AromaticContact CZ-CD2 3.43Å; F340-H349 VanDerWaalsContact CZ-CD2 3.43Å; F340-H349 WeakPolarHBondContact CZ-CD2 3.37Å; F340-H349 AromaticContact CZ-CG 3.16Å; F340-H349 AromaticContact CZ-ND1 3.78Å; E345-H349 VanDerWaalsContact O-CB 3.31Å; E345-H349 WeakPolarHBondContact O-CB 3.29Å; E345-H349 PolarHBondContact O-N 3.46Å; L346-H349 CarbonylContact O-C 3.42Å; L346-H349 WeakPolarHBondContact O-CA 3.3Å; L346-H349 WeakPolarHBondContact O-CB 3.25Å; L346-H349 PolarHBondContact O-N 2.93Å; T347-H349 VanDerWaalsContact C-N 3.35Å; H349-R351 PolarHBondContact O-N 3.39Å; H349-R351 VanDerWaalsContact O-N 3.13Å; H349-I352 WeakPolarHBondContact O-CB 3.47Å; H349-I352 WeakPolarHBondContact O-CG1 3.48Å; H349-I352 PolarHBondContact O-N 2.88Å; H349-H353 AromaticContact CD2-NE2 3.98Å; H349-H353 AromaticContact CE1-NE2 3.6Å; H349-H353 AromaticContact NE2-CD2 3.96Å; H349-H353 AromaticContact NE2-NE2 3.15Å; H349-H353 PolarHBondContact NE2-NE2 3.22Å; H349-H353 VanDerWaalsContact NE2-NE2 3.15Å
350I92.4Very high91.8Very high53 Ų5369.7 Ų69.727%0.27236%0.358SS..Hα-helixtrans-56.6-31.1178-69.9166.1000111.5P332 L346 I352 H353 T354P332-I350 HydrophobicContact CG-CD1 4.25Å; L346-I350 HydrophobicContact CD1-CD1 3.87Å; L346-I350 HydrophobicContact CD1-CG1 3.94Å; L346-I350 HydrophobicContact CD2-CD1 4.46Å; L346-I350 HydrophobicContact CG-CD1 3.82Å; L346-I350 HydrophobicContact CG-CG1 4.35Å; L346-I350 WeakPolarHBondContact O-CG1 3.22Å; L346-I350 PolarHBondContact O-N 3.31Å; I350-I352 PolarHBondContact O-N 3.27Å; I350-I352 VanDerWaalsContact O-N 3.09Å; I350-H353 WeakPolarHBondContact O-CB 3.39Å; I350-H353 PolarHBondContact O-N 3.21Å; I350-T354 HydrophobicContact CG2-CG2 4.1Å; I350-T354 PolarHBondContact O-N 3.26Å; I350-T354 PolarHBondContact O-OG1 3.06Å
351R92.8Very high92Very high65 Ų6568.6 Ų68.625%0.24535%0.353CS..Hα-helixtrans-59.9-19.5174.5-62.4176.5-169-177.8-1.6114.1R348 H349 T354 G355 H356 S369R348-R351 WeakPolarHBondContact O-CB 3.31Å; R348-R351 PolarHBondContact O-N 3.41Å; H349-R351 PolarHBondContact O-N 3.39Å; H349-R351 VanDerWaalsContact O-N 3.13Å; R351-T354 WeakPolarHBondContact CA-OG1 3.44Å; R351-G355 CarbonylContact O-C 3.54Å; R351-G355 WeakPolarHBondContact O-CA 3.41Å; R351-G355 PolarHBondContact O-N 3.21Å; R351-G355 VanDerWaalsContact O-N 3.08Å; R351-H356 HydrophobicContact CG-CB 4.44Å; R351-H356 PolarHBondContact O-N 3.48Å; R351-S369 PolarHBondContact NH1-O 3.42Å
352I90.6Very high92Very high110 Ų11077.4 Ų77.456%0.56438%0.378SS*.Hα-helixtrans-71.7-41.2174.6-58.1176.9000109.7H349 I350H349-I352 WeakPolarHBondContact O-CB 3.47Å; H349-I352 WeakPolarHBondContact O-CG1 3.48Å; H349-I352 PolarHBondContact O-N 2.88Å; I350-I352 PolarHBondContact O-N 3.27Å; I350-I352 VanDerWaalsContact O-N 3.09Å
353H90.9Very high92.1Very high86 Ų8675.8 Ų75.840%0.39838%0.379SS..Hα-helixtrans-72.8-43.2179-58.9-49.8000111.8C331 A333 C336 H349 I350 G355C331-H353 VanDerWaalsContact SG-CD2 3.56Å; C331-H353 PolarHBondContact SG-NE2 2.94Å; A333-H353 HydrophobicContact CB-CB 4.45Å; A333-H353 VanDerWaalsContact CB-CD2 3.41Å; A333-H353 WeakPolarHBondContact CB-CD2 3.42Å; C336-H353 PolarHBondContact SG-NE2 3.39Å; H349-H353 AromaticContact CD2-NE2 3.98Å; H349-H353 AromaticContact CE1-NE2 3.6Å; H349-H353 AromaticContact NE2-CD2 3.96Å; H349-H353 AromaticContact NE2-NE2 3.15Å; H349-H353 PolarHBondContact NE2-NE2 3.22Å; H349-H353 VanDerWaalsContact NE2-NE2 3.15Å; I350-H353 WeakPolarHBondContact O-CB 3.39Å; I350-H353 PolarHBondContact O-N 3.21Å; H353-G355 VanDerWaalsContact C-N 3.28Å; H353-G355 PolarHBondContact O-N 3.2Å
354T89.4Confident92.3Very high93 Ų9375.5 Ų75.557%0.57138%0.376SS*.SBendtrans-81-9.4-179.662.30000113.6I350 R351 H356I350-T354 HydrophobicContact CG2-CG2 4.1Å; I350-T354 PolarHBondContact O-N 3.26Å; I350-T354 PolarHBondContact O-OG1 3.06Å; R351-T354 WeakPolarHBondContact CA-OG1 3.44Å; T354-H356 PolarHBondContact O-N 3.4Å; T354-H356 VanDerWaalsContact O-N 3.08Å; T354-H356 WeakPolarHBondContact OG1-CB 3.26Å; T354-H356 PolarHBondContact OG1-N 2.81Å
355G89.5Confident92.4Very high45 Ų4578.3 Ų78.346%0.46439%0.389SS..  trans63.210.3-172.200000114.2R351 H353 K357R351-G355 CarbonylContact O-C 3.54Å; R351-G355 WeakPolarHBondContact O-CA 3.41Å; R351-G355 PolarHBondContact O-N 3.21Å; R351-G355 VanDerWaalsContact O-N 3.08Å; H353-G355 VanDerWaalsContact C-N 3.28Å; H353-G355 PolarHBondContact O-N 3.2Å; G355-K357 WeakPolarHBondContact O-CG 3.5Å; G355-K357 PolarHBondContact O-N 2.89Å
356H92.1Very high92.5Very high104 Ų10483.5 Ų83.548%0.48141%0.406SS..  trans-67.1120.2-174-177.1-117.8000111.8R351 T354R351-H356 HydrophobicContact CG-CB 4.44Å; R351-H356 PolarHBondContact O-N 3.48Å; T354-H356 PolarHBondContact O-N 3.4Å; T354-H356 VanDerWaalsContact O-N 3.08Å; T354-H356 WeakPolarHBondContact OG1-CB 3.26Å; T354-H356 PolarHBondContact OG1-N 2.81Å
357K92.4Very high92.5Very high115 Ų11585.7 Ų85.750%0.542%0.418SS..  trans-126.882.8-175.6-69.3170.9-176.7-171.30110.8G355 F359 N367 F368G355-K357 WeakPolarHBondContact O-CG 3.5Å; G355-K357 PolarHBondContact O-N 2.89Å; K357-F359 VanDerWaalsContact C-N 3.25Å; K357-F359 PolarHBondContact O-N 3.46Å; K357-N367 HydrophobicContact CB-CB 3.7Å; K357-N367 HydrophobicContact CD-CB 4.27Å; K357-F368 CarbonylContact C-O 3.15Å; K357-F368 VanDerWaalsContact C-O 3.31Å; K357-F368 WeakPolarHBondContact CA-O 3.5Å
358P90.3Very high92.6Very high61 Ų6183.7 Ų83.740%0.39640%0.403SS..  trans-74.9-11.4-172.427.9-33000114.1
359F94.5Very high92.7Very high62 Ų6281.2 Ų81.227%0.27240%0.399SS..EExtended strand (participates in β ladder)trans-104.7106.6-172.4-58.1-73.9000111.3K357 N367 F368 R370 S371 L374K357-F359 VanDerWaalsContact C-N 3.25Å; K357-F359 PolarHBondContact O-N 3.46Å; F359-N367 CarbonylContact O-C 3.31Å; F359-N367 WeakPolarHBondContact O-CA 3.14Å; F359-F368 HydrophobicContact CB-CB 4.25Å; F359-F368 WeakPolarHBondContact CB-O 3.41Å; F359-F368 PolarHBondContact N-O 3.27Å; F359-F368 PolarHBondContact O-N 3.29Å; F359-R370 VanDerWaalsContact CD2-CA 3.48Å; F359-S371 VanDerWaalsContact CD2-N 3.33Å; F359-S371 VanDerWaalsContact CE2-N 3.32Å; F359-L374 HydrophobicContact CB-CB 4.14Å; F359-L374 HydrophobicContact CB-CD2 3.87Å
360Q95.1Very high92.6Very high88 Ų8884.7 Ų84.741%0.41141%0.411SS..EExtended strand (participates in β ladder)trans-97136.5-179.9-169.2167.443.800112.6M365 N367 L374Q360-M365 HydrophobicContact CG-CE 4.48Å; Q360-M365 HydrophobicContact CG-SD 4.45Å; Q360-M365 PolarHBondContact NE2-O 3.38Å; Q360-N367 VanDerWaalsContact CB-OD1 3.26Å; Q360-N367 WeakPolarHBondContact CB-OD1 3.04Å; Q360-N367 VanDerWaalsContact CG-OD1 3.27Å; Q360-N367 WeakPolarHBondContact CG-OD1 3.43Å; Q360-L374 WeakPolarHBondContact O-CD2 3.47Å
361C95.3Very high92.6Very high0 Ų085.2 Ų85.20%042%0.42CS..  trans-75.3122.5168.2-177.40000110.5I363 C364 M365 R366 F368 L374 H377C361-I363 PolarHBondContact O-N 2.93Å; C361-C364 VanDerWaalsContact SG-SG 3.64Å; C361-M365 WeakPolarHBondContact O-CA 3.42Å; C361-M365 PolarHBondContact O-N 3.29Å; C361-R366 WeakPolarHBondContact CB-O 3.37Å; C361-R366 PolarHBondContact N-O 3.13Å; C361-F368 HydrophobicContact CB-CE2 4.13Å; C361-L374 VanDerWaalsContact CA-CD1 3.5Å; C361-L374 HydrophobicContact CB-CD1 3.73Å; C361-H377 VanDerWaalsContact SG-CD2 3.51Å; C361-H377 PolarHBondContact SG-NE2 3.19Å; C361-H377 VanDerWaalsContact SG-NE2 3.4Å
362R93.8Very high92.5Very high239 Ų23985.3 Ų85.390%0.90243%0.425SS*.THydrogen-bonded Turntrans-70.7-15.4179.3-63.1-175.3-177.8173.8-0.1114.1
363I93.8Very high92.6Very high102 Ų10282.8 Ų82.852%0.52341%0.411SS..THydrogen-bonded Turntrans-91-46.3-175.3-57.6171.5000111C361 H381C361-I363 PolarHBondContact O-N 2.93Å; I363-H381 HydrophobicContact CD1-CB 3.42Å; I363-H381 VanDerWaalsContact CD1-CB 3.42Å; I363-H381 HydrophobicContact CG2-CB 4.27Å
364C93.8Very high92.8Very high58 Ų5879.8 Ų79.839%0.39240%0.398SS..THydrogen-bonded Turntrans-1199.5-178.267.20000113.9C361 R366 H377 H381C361-C364 VanDerWaalsContact SG-SG 3.64Å; C364-R366 PolarHBondContact O-N 3.5Å; C364-H377 PolarHBondContact SG-NE2 3.49Å; C364-H381 PolarHBondContact SG-NE2 3.49Å
365M93.1Very high93Very high109 Ų10978.9 Ų78.954%0.53739%0.392SS..  trans57.810178.5-57.7-56-80.900115.7Q360 C361Q360-M365 HydrophobicContact CG-CE 4.48Å; Q360-M365 HydrophobicContact CG-SD 4.45Å; Q360-M365 PolarHBondContact NE2-O 3.38Å; C361-M365 WeakPolarHBondContact O-CA 3.42Å; C361-M365 PolarHBondContact O-N 3.29Å
366R93.8Very high93.1Very high164 Ų16478.1 Ų78.162%0.61938%0.379SS*.  trans-70.3133.5178.7-169.4171.1-176.4168.92.9111.3C361 C364 F368C361-R366 WeakPolarHBondContact CB-O 3.37Å; C361-R366 PolarHBondContact N-O 3.13Å; C364-R366 PolarHBondContact O-N 3.5Å; R366-F368 HydrophobicContact CB-CE2 4.07Å; R366-F368 HydrophobicContact CB-CZ 4.37Å; R366-F368 HydrophobicContact CG-CE2 4.08Å; R366-F368 HydrophobicContact CG-CZ 4.03Å; R366-F368 WeakPolarHBondContact O-CD2 3.5Å; R366-F368 WeakPolarHBondContact O-CE2 3.28Å
367N94.3Very high93.1Very high72 Ų7274.5 Ų74.539%0.38536%0.362SS..EExtended strand (participates in β ladder)trans-94.4141.9-179.1-62.3-56.8000112.5K357 F359 Q360K357-N367 HydrophobicContact CB-CB 3.7Å; K357-N367 HydrophobicContact CD-CB 4.27Å; F359-N367 CarbonylContact O-C 3.31Å; F359-N367 WeakPolarHBondContact O-CA 3.14Å; Q360-N367 VanDerWaalsContact CB-OD1 3.26Å; Q360-N367 WeakPolarHBondContact CB-OD1 3.04Å; Q360-N367 VanDerWaalsContact CG-OD1 3.27Å; Q360-N367 WeakPolarHBondContact CG-OD1 3.43Å
368F93.1Very high93.2Very high33 Ų3372.1 Ų72.115%0.14535%0.354CS..EExtended strand (participates in β ladder)trans-127.4145.7-179.5-62.2-89.7000110.4K357 F359 C361 R366 R370 H373 L374 H377K357-F368 CarbonylContact C-O 3.15Å; K357-F368 VanDerWaalsContact C-O 3.31Å; K357-F368 WeakPolarHBondContact CA-O 3.5Å; F359-F368 HydrophobicContact CB-CB 4.25Å; F359-F368 WeakPolarHBondContact CB-O 3.41Å; F359-F368 PolarHBondContact N-O 3.27Å; F359-F368 PolarHBondContact O-N 3.29Å; C361-F368 HydrophobicContact CB-CE2 4.13Å; R366-F368 HydrophobicContact CB-CE2 4.07Å; R366-F368 HydrophobicContact CB-CZ 4.37Å; R366-F368 HydrophobicContact CG-CE2 4.08Å; R366-F368 HydrophobicContact CG-CZ 4.03Å; R366-F368 WeakPolarHBondContact O-CD2 3.5Å; R366-F368 WeakPolarHBondContact O-CE2 3.28Å; F368-R370 VanDerWaalsContact C-N 3.29Å; F368-H373 HydrophobicContact CD1-CB 4.07Å; F368-L374 HydrophobicContact CB-CB 4.33Å; F368-L374 HydrophobicContact CD2-CB 4.1Å; F368-L374 HydrophobicContact CD2-CD1 3.89Å; F368-L374 HydrophobicContact CE2-CD1 4.11Å; F368-L374 HydrophobicContact CG-CB 4.33Å; F368-H377 HydrophobicContact CE1-CB 3.97Å; F368-H377 HydrophobicContact CE2-CB 4.04Å; F368-H377 AromaticContact CE2-CD2 3.37Å; F368-H377 WeakPolarHBondContact CE2-CD2 3.19Å; F368-H377 AromaticContact CE2-CG 3.7Å; F368-H377 HydrophobicContact CZ-CB 3.53Å; F368-H377 AromaticContact CZ-CD2 3.37Å; F368-H377 WeakPolarHBondContact CZ-CD2 3.38Å; F368-H377 AromaticContact CZ-CG 3.22Å; F368-H377 AromaticContact CZ-ND1 3.75Å; F368-H377 AromaticContact CZ-NE2 3.93Å
369S92.6Very high93.3Very high35 Ų3571.8 Ų71.825%0.24535%0.345CS..SBendtrans-78.6-15.2177.355.40000113.2R351R351-S369 PolarHBondContact NH1-O 3.42Å
370R91.4Very high93.2Very high84 Ų8473.3 Ų73.332%0.31736%0.359SS..SBendtrans-137.3144-176.4-59.7167.849.3164.92.9112.3R348 F359 F368 D372 H373 L374R348-R370 HydrophobicContact CG-CG 4.05Å; F359-R370 VanDerWaalsContact CD2-CA 3.48Å; F368-R370 VanDerWaalsContact C-N 3.29Å; R370-D372 WeakPolarHBondContact CB-OD1 3.49Å; R370-D372 IonicContact CZ-OD1 3.61Å; R370-D372 IonicContact CZ-OD2 3.45Å; R370-D372 IonicContact NE-OD1 3.39Å; R370-D372 PolarHBondContact NE-OD1 2.74Å; R370-D372 IonicContact NE-OD2 2.83Å; R370-D372 VanDerWaalsContact NH2-CG 3.34Å; R370-D372 IonicContact NH2-OD1 3.94Å; R370-D372 PolarHBondContact NH2-OD1 2.83Å; R370-D372 IonicContact NH2-OD2 2.74Å; R370-D372 PolarHBondContact NH2-OD2 2.69Å; R370-H373 HydrophobicContact CB-CB 4.36Å; R370-H373 VanDerWaalsContact CD-NE2 3.31Å; R370-H373 WeakPolarHBondContact CD-NE2 3.47Å; R370-H373 VanDerWaalsContact CZ-CE1 3.49Å; R370-H373 PolarHBondContact NE-NE2 3.13Å; R370-H373 PolarHBondContact O-N 3.33Å; R370-L374 PolarHBondContact O-N 2.74Å
371S92.6Very high93Very high65 Ų6572.7 Ų72.746%0.45536%0.356SS..Hα-helixtrans-67.6-40.6179.953.10000112.4F359 H373 L374 T375F359-S371 VanDerWaalsContact CD2-N 3.33Å; F359-S371 VanDerWaalsContact CE2-N 3.32Å; S371-H373 VanDerWaalsContact C-N 3.26Å; S371-H373 PolarHBondContact O-N 3.43Å; S371-L374 WeakPolarHBondContact O-CA 3.36Å; S371-L374 WeakPolarHBondContact O-CB 3.34Å; S371-L374 PolarHBondContact O-N 3.39Å; S371-L374 VanDerWaalsContact O-N 3.1Å; S371-T375 PolarHBondContact O-N 3.37Å; S371-T375 PolarHBondContact O-OG1 3.44Å; S371-T375 VanDerWaalsContact O-OG1 3.13Å
372D90.6Very high92.7Very high66 Ų6676.2 Ų76.235%0.35338%0.378SS..Hα-helixtrans-62.1-36.1178.465.5-54000111.8R370 T375 T376R370-D372 WeakPolarHBondContact CB-OD1 3.49Å; R370-D372 IonicContact CZ-OD1 3.61Å; R370-D372 IonicContact CZ-OD2 3.45Å; R370-D372 IonicContact NE-OD1 3.39Å; R370-D372 PolarHBondContact NE-OD1 2.74Å; R370-D372 IonicContact NE-OD2 2.83Å; R370-D372 VanDerWaalsContact NH2-CG 3.34Å; R370-D372 IonicContact NH2-OD1 3.94Å; R370-D372 PolarHBondContact NH2-OD1 2.83Å; R370-D372 IonicContact NH2-OD2 2.74Å; R370-D372 PolarHBondContact NH2-OD2 2.69Å; D372-T375 PolarHBondContact O-N 2.98Å; D372-T376 WeakPolarHBondContact O-CG2 3.49Å; D372-T376 PolarHBondContact O-N 2.85Å; D372-T376 PolarHBondContact O-OG1 3.29Å
373H92.6Very high92.5Very high57 Ų5767.1 Ų67.126%0.26436%0.358SS..Hα-helixtrans-66-43.7173.2-64.8-12.2000111.8F368 R370 S371 T376 H377F368-H373 HydrophobicContact CD1-CB 4.07Å; R370-H373 HydrophobicContact CB-CB 4.36Å; R370-H373 VanDerWaalsContact CD-NE2 3.31Å; R370-H373 WeakPolarHBondContact CD-NE2 3.47Å; R370-H373 VanDerWaalsContact CZ-CE1 3.49Å; R370-H373 PolarHBondContact NE-NE2 3.13Å; R370-H373 PolarHBondContact O-N 3.33Å; S371-H373 VanDerWaalsContact C-N 3.26Å; S371-H373 PolarHBondContact O-N 3.43Å; H373-T376 WeakPolarHBondContact CA-OG1 3.44Å; H373-T376 PolarHBondContact O-N 2.83Å; H373-T376 PolarHBondContact O-OG1 2.83Å; H373-H377 VanDerWaalsContact O-CB 3.28Å; H373-H377 WeakPolarHBondContact O-CB 3.4Å; H373-H377 PolarHBondContact O-N 3.39Å
374L94.8Very high92.3Very high24 Ų2467.7 Ų67.713%0.12636%0.359CS..Hα-helixtrans-59-47.7173.2171.861.9000111.5F359 Q360 C361 F368 R370 S371 T376 H377 I378F359-L374 HydrophobicContact CB-CB 4.14Å; F359-L374 HydrophobicContact CB-CD2 3.87Å; Q360-L374 WeakPolarHBondContact O-CD2 3.47Å; C361-L374 VanDerWaalsContact CA-CD1 3.5Å; C361-L374 HydrophobicContact CB-CD1 3.73Å; F368-L374 HydrophobicContact CB-CB 4.33Å; F368-L374 HydrophobicContact CD2-CB 4.1Å; F368-L374 HydrophobicContact CD2-CD1 3.89Å; F368-L374 HydrophobicContact CE2-CD1 4.11Å; F368-L374 HydrophobicContact CG-CB 4.33Å; R370-L374 PolarHBondContact O-N 2.74Å; S371-L374 WeakPolarHBondContact O-CA 3.36Å; S371-L374 WeakPolarHBondContact O-CB 3.34Å; S371-L374 PolarHBondContact O-N 3.39Å; S371-L374 VanDerWaalsContact O-N 3.1Å; L374-T376 PolarHBondContact O-N 3.09Å; L374-H377 CarbonylContact O-C 3.32Å; L374-H377 WeakPolarHBondContact O-CA 3.49Å; L374-H377 WeakPolarHBondContact O-CB 3.16Å; L374-H377 PolarHBondContact O-N 2.93Å; L374-H377 VanDerWaalsContact O-N 3.09Å; L374-I378 HydrophobicContact CD1-CD1 3.94Å; L374-I378 HydrophobicContact CD1-CG1 4.01Å; L374-I378 HydrophobicContact CG-CD1 3.94Å; L374-I378 HydrophobicContact CG-CG1 4.45Å; L374-I378 WeakPolarHBondContact O-CG1 3.47Å; L374-I378 PolarHBondContact O-N 3.41Å
375T92.8Very high92.1Very high73 Ų7370.8 Ų70.845%0.44837%0.366SS..Hα-helixtrans-59.8-45.2178.5-54.20000111.6S371 D372 H377 I378 R379S371-T375 PolarHBondContact O-N 3.37Å; S371-T375 PolarHBondContact O-OG1 3.44Å; S371-T375 VanDerWaalsContact O-OG1 3.13Å; D372-T375 PolarHBondContact O-N 2.98Å; T375-H377 VanDerWaalsContact C-N 3.28Å; T375-H377 PolarHBondContact O-N 3.33Å; T375-I378 PolarHBondContact O-N 3.4Å; T375-R379 PolarHBondContact O-N 3.42Å
376T92.1Very high92Very high30 Ų3069.2 Ų69.218%0.18436%0.364CS..Hα-helixtrans-66.6-31.217657.70000112.8D372 H373 L374 R379 R398D372-T376 WeakPolarHBondContact O-CG2 3.49Å; D372-T376 PolarHBondContact O-N 2.85Å; D372-T376 PolarHBondContact O-OG1 3.29Å; H373-T376 WeakPolarHBondContact CA-OG1 3.44Å; H373-T376 PolarHBondContact O-N 2.83Å; H373-T376 PolarHBondContact O-OG1 2.83Å; L374-T376 PolarHBondContact O-N 3.09Å; T376-R379 WeakPolarHBondContact O-CB 3.16Å; T376-R379 PolarHBondContact O-N 3.1Å; T376-R398 HydrophobicContact CG2-CG 3.96Å
377H93.3Very high91.9Very high28 Ų2864.2 Ų64.213%0.1335%0.347CS..Hα-helixtrans-71-39.1174.917165.4000111.8C361 C364 F368 H373 L374 T375 R379 T380 H381C361-H377 VanDerWaalsContact SG-CD2 3.51Å; C361-H377 PolarHBondContact SG-NE2 3.19Å; C361-H377 VanDerWaalsContact SG-NE2 3.4Å; C364-H377 PolarHBondContact SG-NE2 3.49Å; F368-H377 HydrophobicContact CE1-CB 3.97Å; F368-H377 HydrophobicContact CE2-CB 4.04Å; F368-H377 AromaticContact CE2-CD2 3.37Å; F368-H377 WeakPolarHBondContact CE2-CD2 3.19Å; F368-H377 AromaticContact CE2-CG 3.7Å; F368-H377 HydrophobicContact CZ-CB 3.53Å; F368-H377 AromaticContact CZ-CD2 3.37Å; F368-H377 WeakPolarHBondContact CZ-CD2 3.38Å; F368-H377 AromaticContact CZ-CG 3.22Å; F368-H377 AromaticContact CZ-ND1 3.75Å; F368-H377 AromaticContact CZ-NE2 3.93Å; H373-H377 VanDerWaalsContact O-CB 3.28Å; H373-H377 WeakPolarHBondContact O-CB 3.4Å; H373-H377 PolarHBondContact O-N 3.39Å; L374-H377 CarbonylContact O-C 3.32Å; L374-H377 WeakPolarHBondContact O-CA 3.49Å; L374-H377 WeakPolarHBondContact O-CB 3.16Å; L374-H377 PolarHBondContact O-N 2.93Å; L374-H377 VanDerWaalsContact O-N 3.09Å; T375-H377 VanDerWaalsContact C-N 3.28Å; T375-H377 PolarHBondContact O-N 3.33Å; H377-R379 PolarHBondContact O-N 3.1Å; H377-T380 WeakPolarHBondContact O-CB 3.01Å; H377-T380 PolarHBondContact O-N 2.92Å; H377-T380 PolarHBondContact O-OG1 2.86Å; H377-H381 AromaticContact CE1-NE2 3.44Å; H377-H381 PolarHBondContact CE1-NE2 2.88Å; H377-H381 AromaticContact NE2-CD2 3.75Å; H377-H381 AromaticContact NE2-NE2 3.11Å; H377-H381 PolarHBondContact NE2-NE2 3.15Å; H377-H381 VanDerWaalsContact NE2-NE2 3.11Å
378I93.3Very high91.8Very high64 Ų6462.8 Ų62.833%0.32835%0.345SS..Hα-helixtrans-58.2-34.6176.3-70.4165.8000111L374 T375 T380 H381 T382L374-I378 HydrophobicContact CD1-CD1 3.94Å; L374-I378 HydrophobicContact CD1-CG1 4.01Å; L374-I378 HydrophobicContact CG-CD1 3.94Å; L374-I378 HydrophobicContact CG-CG1 4.45Å; L374-I378 WeakPolarHBondContact O-CG1 3.47Å; L374-I378 PolarHBondContact O-N 3.41Å; T375-I378 PolarHBondContact O-N 3.4Å; I378-T380 PolarHBondContact O-N 3.17Å; I378-T380 VanDerWaalsContact O-N 3.15Å; I378-H381 WeakPolarHBondContact O-CB 3.31Å; I378-H381 PolarHBondContact O-N 2.88Å; I378-T382 HydrophobicContact CG2-CG2 4.29Å; I378-T382 PolarHBondContact O-N 3.19Å; I378-T382 VanDerWaalsContact O-N 3.1Å
379R93.4Very high91.9Very high55 Ų5561.3 Ų61.321%0.20834%0.339CS..Hα-helixtrans-61.4-21174.1-64.2179.7179.8156.33.3114.1T375 T376 H377 H381 T382 G383 E384 A397T375-R379 PolarHBondContact O-N 3.42Å; T376-R379 WeakPolarHBondContact O-CB 3.16Å; T376-R379 PolarHBondContact O-N 3.1Å; H377-R379 PolarHBondContact O-N 3.1Å; R379-H381 VanDerWaalsContact C-N 3.29Å; R379-T382 WeakPolarHBondContact CA-OG1 3.49Å; R379-G383 WeakPolarHBondContact O-CA 3.26Å; R379-G383 PolarHBondContact O-N 2.95Å; R379-E384 HydrophobicContact CG-CB 4.35Å; R379-E384 PolarHBondContact O-N 3.32Å; R379-A397 HydrophobicContact CB-CB 4.45Å; R379-A397 WeakPolarHBondContact CD-O 3.31Å; R379-A397 PolarHBondContact NH1-O 2.75Å
380T90.9Very high91.9Very high94 Ų9465.9 Ų65.958%0.57736%0.36SS*.Hα-helixtrans-74.1-24.8173.872.40000112.1H377 I378H377-T380 WeakPolarHBondContact O-CB 3.01Å; H377-T380 PolarHBondContact O-N 2.92Å; H377-T380 PolarHBondContact O-OG1 2.86Å; I378-T380 PolarHBondContact O-N 3.17Å; I378-T380 VanDerWaalsContact O-N 3.15Å
381H90.8Very high91.8Very high74 Ų7468.1 Ų68.134%0.34337%0.369SS..Hα-helixtrans-84.3-42.2174.4-64.9-67.8000111.8I363 C364 H377 I378 R379 G383I363-H381 HydrophobicContact CD1-CB 3.42Å; I363-H381 VanDerWaalsContact CD1-CB 3.42Å; I363-H381 HydrophobicContact CG2-CB 4.27Å; C364-H381 PolarHBondContact SG-NE2 3.49Å; H377-H381 AromaticContact CE1-NE2 3.44Å; H377-H381 PolarHBondContact CE1-NE2 2.88Å; H377-H381 AromaticContact NE2-CD2 3.75Å; H377-H381 AromaticContact NE2-NE2 3.11Å; H377-H381 PolarHBondContact NE2-NE2 3.15Å; H377-H381 VanDerWaalsContact NE2-NE2 3.11Å; I378-H381 WeakPolarHBondContact O-CB 3.31Å; I378-H381 PolarHBondContact O-N 2.88Å; R379-H381 VanDerWaalsContact C-N 3.29Å; H381-G383 VanDerWaalsContact C-N 3.34Å
382T89.9Confident91.8Very high74 Ų7468.1 Ų68.145%0.45437%0.369SS..Hα-helixtrans-80.8-16.2-179.4620000113.3I378 R379 E384I378-T382 HydrophobicContact CG2-CG2 4.29Å; I378-T382 PolarHBondContact O-N 3.19Å; I378-T382 VanDerWaalsContact O-N 3.1Å; R379-T382 WeakPolarHBondContact CA-OG1 3.49Å; T382-E384 PolarHBondContact O-N 3.02Å; T382-E384 WeakPolarHBondContact OG1-CG 3.31Å
383G89.1Confident91.8Very high48 Ų4867.2 Ų67.250%0.49538%0.375SS..  trans71.28.4-176.100000114.1R379 H381 K385R379-G383 WeakPolarHBondContact O-CA 3.26Å; R379-G383 PolarHBondContact O-N 2.95Å; H381-G383 VanDerWaalsContact C-N 3.34Å; G383-K385 PolarHBondContact O-N 3.25Å
384E90.4Very high91.8Very high115 Ų11572.1 Ų72.154%0.53739%0.391SS..  trans-64.4127-179.3-74.9178.1-170.900112.2R379 T382 P386R379-E384 HydrophobicContact CG-CB 4.35Å; R379-E384 PolarHBondContact O-N 3.32Å; T382-E384 PolarHBondContact O-N 3.02Å; T382-E384 WeakPolarHBondContact OG1-CG 3.31Å; E384-P386 WeakPolarHBondContact O-CD 3.45Å
385K90.3Very high91.7Very high122 Ų12277.4 Ų77.453%0.5341%0.413SS..  trans-125.579.2178.4-65.9173-176.3176.50110.3G383 F387 K395 F396G383-K385 PolarHBondContact O-N 3.25Å; K385-F387 VanDerWaalsContact C-N 3.25Å; K385-F387 PolarHBondContact O-N 3.17Å; K385-K395 HydrophobicContact CB-CB 3.61Å; K385-K395 HydrophobicContact CD-CB 4.39Å; K385-F396 CarbonylContact C-O 3.48Å; K385-F396 VanDerWaalsContact CA-O 3.31Å; K385-F396 WeakPolarHBondContact CA-O 3.26Å
386P89.5Confident91.6Very high76 Ų7675.2 Ų75.249%0.49440%0.398SS..  trans-73.1-15.4-173.326.8-32.7000113.6E384E384-P386 WeakPolarHBondContact O-CD 3.45Å
387F92.1Very high91.5Very high60 Ų6074.7 Ų74.726%0.26340%0.396SS..EExtended strand (participates in β ladder)trans-102.799.3-172.9-57.7-71.8000111.7K385 K395 F396 A397 R402K385-F387 VanDerWaalsContact C-N 3.25Å; K385-F387 PolarHBondContact O-N 3.17Å; F387-K395 CarbonylContact O-C 3.55Å; F387-K395 WeakPolarHBondContact O-CA 3.27Å; F387-F396 HydrophobicContact CB-CB 4.34Å; F387-F396 PolarHBondContact N-O 3.39Å; F387-F396 VanDerWaalsContact N-O 3.12Å; F387-F396 PolarHBondContact O-N 3.17Å; F387-A397 WeakPolarHBondContact CE2-O 3.36Å; F387-R402 HydrophobicContact CB-CB 4.08Å; F387-R402 HydrophobicContact CB-CG 4.47Å
388A92.4Very high91.3Very high42 Ų4277.4 Ų77.435%0.34741%0.405SS..EExtended strand (participates in β ladder)trans-85.2141.3173.800000111.9R394 K395 R402A388-R394 CarbonylContact C-O 3.58Å; A388-R394 WeakPolarHBondContact CA-O 3.37Å; A388-K395 HydrophobicContact CB-CG 4.2Å; A388-R402 WeakPolarHBondContact O-CD 3.39Å
389C94.4Very high91.2Very high2 Ų276.5 Ų76.51%0.01441%0.405CS..  trans-76.2129.8169.7-179.10000110.5Y391 C392 G393 R394 F396 H405C389-Y391 VanDerWaalsContact C-N 3.25Å; C389-Y391 PolarHBondContact O-N 3.5Å; C389-C392 VanDerWaalsContact SG-SG 3.62Å; C389-G393 VanDerWaalsContact O-CA 3.25Å; C389-G393 WeakPolarHBondContact O-CA 3.44Å; C389-G393 PolarHBondContact O-N 3.08Å; C389-R394 PolarHBondContact N-O 3.38Å; C389-F396 HydrophobicContact CB-CE2 4.18Å; C389-H405 VanDerWaalsContact SG-CD2 3.52Å
390D92.3Very high91.1Very high130 Ų13076.5 Ų76.570%0.69541%0.409SS*.THydrogen-bonded Turntrans-69.6-24.2-176.7-48.3-43.1000112.5R402D390-R402 IonicContact OD1-NH1 2.93Å; D390-R402 IonicContact OD2-NH1 3.39Å; D390-R402 PolarHBondContact OD2-NH1 3.14Å
391Y90.8Very high91.2Very high131 Ų13175 Ų7551%0.51440%0.395SS..THydrogen-bonded Turntrans-85.8-29.6-178.4-64.6-79.5000114.3C389 T406 H409 L410C389-Y391 VanDerWaalsContact C-N 3.25Å; C389-Y391 PolarHBondContact O-N 3.5Å; Y391-T406 HydrophobicContact CD2-CG2 4.46Å; Y391-H409 HydrophobicContact CD1-CB 4.33Å; Y391-H409 HydrophobicContact CD2-CB 3.82Å; Y391-H409 HydrophobicContact CE2-CB 4.35Å; Y391-H409 HydrophobicContact CG-CB 3.81Å; Y391-H409 AromaticContact CG-CG 3.95Å; Y391-L410 HydrophobicContact CE2-CD1 4Å
392C92.8Very high91.4Very high65 Ų6574.1 Ų74.144%0.43939%0.389SS..THydrogen-bonded Turntrans-138.84.3-171.368.10000114.4C389 R394 H405 H409C389-C392 VanDerWaalsContact SG-SG 3.62Å; C392-R394 PolarHBondContact O-N 3.27Å; C392-R394 VanDerWaalsContact SG-CB 3.58Å; C392-H405 PolarHBondContact SG-NE2 2.69Å; C392-H409 PolarHBondContact SG-NE2 3.44Å; C392-H409 VanDerWaalsContact SG-NE2 3.39Å
393G89.1Confident91.6Very high47 Ų4776.1 Ų76.149%0.48539%0.391SS..  trans68.9-3.7-18000000115.5C389 K395C389-G393 VanDerWaalsContact O-CA 3.25Å; C389-G393 WeakPolarHBondContact O-CA 3.44Å; C389-G393 PolarHBondContact O-N 3.08Å; G393-K395 PolarHBondContact O-N 3.26Å
394R92.5Very high91.8Very high161 Ų16181 Ų8161%0.60840%0.395SS*.  trans-62.4126.5-177-168.9170.1-176.8173.82.5110.9A388 C389 C392 F396A388-R394 CarbonylContact C-O 3.58Å; A388-R394 WeakPolarHBondContact CA-O 3.37Å; C389-R394 PolarHBondContact N-O 3.38Å; C392-R394 PolarHBondContact O-N 3.27Å; C392-R394 VanDerWaalsContact SG-CB 3.58Å; R394-F396 HydrophobicContact CB-CE2 4.03Å; R394-F396 HydrophobicContact CB-CZ 4.21Å; R394-F396 HydrophobicContact CG-CE2 4.04Å; R394-F396 HydrophobicContact CG-CZ 3.84Å; R394-F396 VanDerWaalsContact O-CD2 3.32Å; R394-F396 WeakPolarHBondContact O-CD2 3.41Å; R394-F396 WeakPolarHBondContact O-CE2 3.37Å
395K93.2Very high92Very high134 Ų13476.9 Ų76.958%0.58338%0.375SS*.EExtended strand (participates in β ladder)trans-92.4141.1-177.6-57.6-174.7180178.30112.2K385 F387 A388 G393K385-K395 HydrophobicContact CB-CB 3.61Å; K385-K395 HydrophobicContact CD-CB 4.39Å; F387-K395 CarbonylContact O-C 3.55Å; F387-K395 WeakPolarHBondContact O-CA 3.27Å; A388-K395 HydrophobicContact CB-CG 4.2Å; G393-K395 PolarHBondContact O-N 3.26Å
396F90.7Very high92.1Very high28 Ų2872 Ų7212%0.12336%0.356CS..EExtended strand (participates in β ladder)trans-128.6151.1-178.3-61.1-85.6000111.2K385 F387 C389 R394 E401 R402 H405K385-F396 CarbonylContact C-O 3.48Å; K385-F396 VanDerWaalsContact CA-O 3.31Å; K385-F396 WeakPolarHBondContact CA-O 3.26Å; F387-F396 HydrophobicContact CB-CB 4.34Å; F387-F396 PolarHBondContact N-O 3.39Å; F387-F396 VanDerWaalsContact N-O 3.12Å; F387-F396 PolarHBondContact O-N 3.17Å; C389-F396 HydrophobicContact CB-CE2 4.18Å; R394-F396 HydrophobicContact CB-CE2 4.03Å; R394-F396 HydrophobicContact CB-CZ 4.21Å; R394-F396 HydrophobicContact CG-CE2 4.04Å; R394-F396 HydrophobicContact CG-CZ 3.84Å; R394-F396 VanDerWaalsContact O-CD2 3.32Å; R394-F396 WeakPolarHBondContact O-CD2 3.41Å; R394-F396 WeakPolarHBondContact O-CE2 3.37Å; F396-E401 HydrophobicContact CB-CB 4.11Å; F396-E401 HydrophobicContact CD1-CB 3.86Å; F396-E401 HydrophobicContact CG-CB 4.2Å; F396-R402 HydrophobicContact CB-CB 4.29Å; F396-R402 HydrophobicContact CD2-CB 3.8Å; F396-R402 HydrophobicContact CD2-CG 4.02Å; F396-R402 HydrophobicContact CG-CB 4.23Å; F396-H405 HydrophobicContact CE1-CB 4.12Å; F396-H405 HydrophobicContact CE2-CB 3.94Å; F396-H405 AromaticContact CE2-CD2 3.61Å; F396-H405 AromaticContact CE2-CG 3.83Å; F396-H405 HydrophobicContact CZ-CB 3.49Å; F396-H405 VanDerWaalsContact CZ-CB 3.49Å; F396-H405 AromaticContact CZ-CD2 3.54Å; F396-H405 AromaticContact CZ-CG 3.34Å; F396-H405 AromaticContact CZ-ND1 3.91Å
397A89.5Confident92.3Very high19 Ų1974.6 Ų74.616%0.15736%0.36CS..SBendtrans-78.2-24.7178.400000112R379 F387 E401R379-A397 HydrophobicContact CB-CB 4.45Å; R379-A397 WeakPolarHBondContact CD-O 3.31Å; R379-A397 PolarHBondContact NH1-O 2.75Å; F387-A397 WeakPolarHBondContact CE2-O 3.36Å; A397-E401 PolarHBondContact N-OE2 2.68Å
398R90.1Very high92.3Very high84 Ų8475.7 Ų75.732%0.31737%0.367SS..SBendtrans-127.3150.3179.8-51.8174.644.3154.5-11.1113.4T376 D400 E401 R402T376-R398 HydrophobicContact CG2-CG 3.96Å; R398-D400 VanDerWaalsContact C-N 3.34Å; R398-D400 WeakPolarHBondContact CB-OD1 3.45Å; R398-D400 IonicContact CZ-OD1 2.69Å; R398-D400 IonicContact CZ-OD2 2.83Å; R398-D400 IonicContact NE-OD1 2.87Å; R398-D400 PolarHBondContact NE-OD1 2.87Å; R398-D400 IonicContact NE-OD2 3.6Å; R398-D400 PolarHBondContact NE-OD2 2.92Å; R398-D400 IonicContact NH2-OD1 3.85Å; R398-D400 PolarHBondContact NH2-OD1 3.16Å; R398-D400 IonicContact NH2-OD2 3.29Å; R398-D400 PolarHBondContact NH2-OD2 3.32Å; R398-D400 PolarHBondContact O-N 3.37Å; R398-E401 HydrophobicContact CB-CG 4.09Å; R398-E401 WeakPolarHBondContact CD-OE1 3.36Å; R398-E401 PolarHBondContact N-OE2 3.09Å; R398-E401 PolarHBondContact O-N 2.87Å; R398-R402 PolarHBondContact O-N 3.04Å
399S91.8Very high92.3Very high46 Ų4675.4 Ų75.432%0.32236%0.359SS..Hα-helixtrans-70.5-31.3-178.484.40000112.7R402 K403S399-R402 PolarHBondContact O-N 2.88Å; S399-K403 VanDerWaalsContact O-CG 3.3Å; S399-K403 WeakPolarHBondContact O-CG 3.45Å; S399-K403 PolarHBondContact O-N 3.42Å
400D91.4Very high92Very high54 Ų5478.9 Ų78.929%0.28938%0.377SS..Hα-helixtrans-70-35.7178.355.6-54.2000112.1R398 K403 R404R398-D400 VanDerWaalsContact C-N 3.34Å; R398-D400 WeakPolarHBondContact CB-OD1 3.45Å; R398-D400 IonicContact CZ-OD1 2.69Å; R398-D400 IonicContact CZ-OD2 2.83Å; R398-D400 IonicContact NE-OD1 2.87Å; R398-D400 PolarHBondContact NE-OD1 2.87Å; R398-D400 IonicContact NE-OD2 3.6Å; R398-D400 PolarHBondContact NE-OD2 2.92Å; R398-D400 IonicContact NH2-OD1 3.85Å; R398-D400 PolarHBondContact NH2-OD1 3.16Å; R398-D400 IonicContact NH2-OD2 3.29Å; R398-D400 PolarHBondContact NH2-OD2 3.32Å; R398-D400 PolarHBondContact O-N 3.37Å; D400-K403 PolarHBondContact O-N 3.22Å; D400-R404 WeakPolarHBondContact O-CB 3.48Å; D400-R404 PolarHBondContact O-N 2.83Å; D400-R404 IonicContact OD2-NH2 3.82Å
401E91.6Very high91.9Very high62 Ų6280.8 Ų80.829%0.2937%0.374SS..Hα-helixtrans-62.4-48.8171-66.4166.4-179.700111F396 A397 R398 K403 R404 H405F396-E401 HydrophobicContact CB-CB 4.11Å; F396-E401 HydrophobicContact CD1-CB 3.86Å; F396-E401 HydrophobicContact CG-CB 4.2Å; A397-E401 PolarHBondContact N-OE2 2.68Å; R398-E401 HydrophobicContact CB-CG 4.09Å; R398-E401 WeakPolarHBondContact CD-OE1 3.36Å; R398-E401 PolarHBondContact N-OE2 3.09Å; R398-E401 PolarHBondContact O-N 2.87Å; E401-K403 VanDerWaalsContact C-N 3.34Å; E401-K403 PolarHBondContact O-N 3.05Å; E401-R404 PolarHBondContact O-N 3.4Å; E401-H405 WeakPolarHBondContact O-CB 3.02Å; E401-H405 PolarHBondContact O-N 3.11Å
402R95.2Very high91.8Very high56 Ų5679 Ų7921%0.21137%0.371CS..Hα-helixtrans-56.4-48.1174-171.8-156.368.3115.20.8111F387 A388 D390 F396 R398 S399 R404 H405 T406F387-R402 HydrophobicContact CB-CB 4.08Å; F387-R402 HydrophobicContact CB-CG 4.47Å; A388-R402 WeakPolarHBondContact O-CD 3.39Å; D390-R402 IonicContact OD1-NH1 2.93Å; D390-R402 IonicContact OD2-NH1 3.39Å; D390-R402 PolarHBondContact OD2-NH1 3.14Å; F396-R402 HydrophobicContact CB-CB 4.29Å; F396-R402 HydrophobicContact CD2-CB 3.8Å; F396-R402 HydrophobicContact CD2-CG 4.02Å; F396-R402 HydrophobicContact CG-CB 4.23Å; R398-R402 PolarHBondContact O-N 3.04Å; S399-R402 PolarHBondContact O-N 2.88Å; R402-R404 PolarHBondContact O-N 3.12Å; R402-H405 WeakPolarHBondContact O-CB 2.97Å; R402-H405 PolarHBondContact O-N 3.44Å; R402-T406 HydrophobicContact CG-CG2 4.36Å; R402-T406 VanDerWaalsContact O-CG2 3.26Å; R402-T406 WeakPolarHBondContact O-CG2 3.43Å; R402-T406 PolarHBondContact O-N 2.83Å; R402-T406 PolarHBondContact O-OG1 3.46Å
403K93.8Very high91.5Very high117 Ų11782.8 Ų82.851%0.50938%0.38SS..Hα-helixtrans-59.3-46.6178.3-75.6174.5-177.3-1790111.7S399 D400 E401 H405 T406 K407S399-K403 VanDerWaalsContact O-CG 3.3Å; S399-K403 WeakPolarHBondContact O-CG 3.45Å; S399-K403 PolarHBondContact O-N 3.42Å; D400-K403 PolarHBondContact O-N 3.22Å; E401-K403 VanDerWaalsContact C-N 3.34Å; E401-K403 PolarHBondContact O-N 3.05Å; K403-H405 VanDerWaalsContact C-N 3.29Å; K403-H405 PolarHBondContact O-N 2.72Å; K403-T406 WeakPolarHBondContact CA-OG1 3.27Å; K403-T406 PolarHBondContact O-N 3.29Å; K403-T406 PolarHBondContact O-OG1 3.46Å; K403-K407 PolarHBondContact O-N 3.25Å
404R93.6Very high91.3Very high150 Ų15086.4 Ų86.457%0.56638%0.384SS*.Hα-helixtrans-60.9-41.1177.2-165.1-173.2-48.8107.47111.2D400 E401 R402 K407D400-R404 WeakPolarHBondContact O-CB 3.48Å; D400-R404 PolarHBondContact O-N 2.83Å; D400-R404 IonicContact OD2-NH2 3.82Å; E401-R404 PolarHBondContact O-N 3.4Å; R402-R404 PolarHBondContact O-N 3.12Å; R404-K407 WeakPolarHBondContact O-CB 3.19Å; R404-K407 PolarHBondContact O-N 3.26Å
405H94.4Very high90.8Very high28 Ų2888 Ų8813%0.1339%0.39CS..Hα-helixtrans-65.9-42.5175.717871.2000112.5C389 C392 F396 E401 R402 K403 K407 I408 H409C389-H405 VanDerWaalsContact SG-CD2 3.52Å; C392-H405 PolarHBondContact SG-NE2 2.69Å; F396-H405 HydrophobicContact CE1-CB 4.12Å; F396-H405 HydrophobicContact CE2-CB 3.94Å; F396-H405 AromaticContact CE2-CD2 3.61Å; F396-H405 AromaticContact CE2-CG 3.83Å; F396-H405 HydrophobicContact CZ-CB 3.49Å; F396-H405 VanDerWaalsContact CZ-CB 3.49Å; F396-H405 AromaticContact CZ-CD2 3.54Å; F396-H405 AromaticContact CZ-CG 3.34Å; F396-H405 AromaticContact CZ-ND1 3.91Å; E401-H405 WeakPolarHBondContact O-CB 3.02Å; E401-H405 PolarHBondContact O-N 3.11Å; R402-H405 WeakPolarHBondContact O-CB 2.97Å; R402-H405 PolarHBondContact O-N 3.44Å; K403-H405 VanDerWaalsContact C-N 3.29Å; K403-H405 PolarHBondContact O-N 2.72Å; H405-K407 PolarHBondContact O-N 3.13Å; H405-I408 VanDerWaalsContact O-CB 3.25Å; H405-I408 WeakPolarHBondContact O-CB 3.46Å; H405-I408 PolarHBondContact O-N 2.84Å; H405-H409 AromaticContact CD2-NE2 3.75Å; H405-H409 AromaticContact CE1-NE2 3.55Å; H405-H409 AromaticContact NE2-CD2 3.69Å; H405-H409 AromaticContact NE2-NE2 2.98Å; H405-H409 PolarHBondContact NE2-NE2 2.84Å
406T92.9Very high90Very high20 Ų2088.7 Ų88.712%0.12339%0.393CS..Hα-helixtrans-58.9-34177.457.80000112.1Y391 R402 K403 I408 H409 L410Y391-T406 HydrophobicContact CD2-CG2 4.46Å; R402-T406 HydrophobicContact CG-CG2 4.36Å; R402-T406 VanDerWaalsContact O-CG2 3.26Å; R402-T406 WeakPolarHBondContact O-CG2 3.43Å; R402-T406 PolarHBondContact O-N 2.83Å; R402-T406 PolarHBondContact O-OG1 3.46Å; K403-T406 WeakPolarHBondContact CA-OG1 3.27Å; K403-T406 PolarHBondContact O-N 3.29Å; K403-T406 PolarHBondContact O-OG1 3.46Å; T406-I408 PolarHBondContact O-N 3.28Å; T406-H409 WeakPolarHBondContact O-CB 3.46Å; T406-H409 PolarHBondContact O-N 3.28Å; T406-L410 WeakPolarHBondContact O-CD1 3.42Å; T406-L410 PolarHBondContact O-N 3Å; T406-L410 VanDerWaalsContact O-N 3.1Å
407K94.2Very high89.3Confident131 Ų13190.1 Ų90.157%0.5741%0.41SS*.Hα-helixtrans-60.7-27.1174.5-68.4-176.7178.7-172.70113.4K403 R404 H405 L410 R411K403-K407 PolarHBondContact O-N 3.25Å; R404-K407 WeakPolarHBondContact O-CB 3.19Å; R404-K407 PolarHBondContact O-N 3.26Å; H405-K407 PolarHBondContact O-N 3.13Å; K407-L410 PolarHBondContact O-N 2.73Å; K407-R411 VanDerWaalsContact O-CG 3.29Å; K407-R411 WeakPolarHBondContact O-CG 3.48Å; K407-R411 PolarHBondContact O-N 3.05Å
408I92.6Very high88.3Confident83 Ų8392.8 Ų92.843%0.42643%0.427SS..Hα-helixtrans-65.9-43.5175.4-56.7173000109.6H405 T406 R411 Q412H405-I408 VanDerWaalsContact O-CB 3.25Å; H405-I408 WeakPolarHBondContact O-CB 3.46Å; H405-I408 PolarHBondContact O-N 2.84Å; T406-I408 PolarHBondContact O-N 3.28Å; I408-R411 PolarHBondContact O-N 2.89Å; I408-Q412 WeakPolarHBondContact O-CB 3.35Å; I408-Q412 VanDerWaalsContact O-CG 3.3Å; I408-Q412 WeakPolarHBondContact O-CG 3.39Å; I408-Q412 PolarHBondContact O-N 3.4Å
409H90.9Very high86.9Confident36 Ų3693.2 Ų93.217%0.16744%0.439CS..Hα-helixtrans-64.9-40.2176-65.6-64.5000112.2Y391 C392 H405 T406 Q412 K413Y391-H409 HydrophobicContact CD1-CB 4.33Å; Y391-H409 HydrophobicContact CD2-CB 3.82Å; Y391-H409 HydrophobicContact CE2-CB 4.35Å; Y391-H409 HydrophobicContact CG-CB 3.81Å; Y391-H409 AromaticContact CG-CG 3.95Å; C392-H409 PolarHBondContact SG-NE2 3.44Å; C392-H409 VanDerWaalsContact SG-NE2 3.39Å; H405-H409 AromaticContact CD2-NE2 3.75Å; H405-H409 AromaticContact CE1-NE2 3.55Å; H405-H409 AromaticContact NE2-CD2 3.69Å; H405-H409 AromaticContact NE2-NE2 2.98Å; H405-H409 PolarHBondContact NE2-NE2 2.84Å; T406-H409 WeakPolarHBondContact O-CB 3.46Å; T406-H409 PolarHBondContact O-N 3.28Å; H409-Q412 PolarHBondContact O-N 3.42Å; H409-K413 WeakPolarHBondContact O-CB 3.32Å; H409-K413 PolarHBondContact O-N 3.24Å
410L89.8Confident85.4Confident74 Ų7495.9 Ų95.939%0.38745%0.454SS..Hα-helixtrans-61.5-45.9174.6-8280.5000111.5Y391 T406 K407 Q412 K413 E414Y391-L410 HydrophobicContact CE2-CD1 4Å; T406-L410 WeakPolarHBondContact O-CD1 3.42Å; T406-L410 PolarHBondContact O-N 3Å; T406-L410 VanDerWaalsContact O-N 3.1Å; K407-L410 PolarHBondContact O-N 2.73Å; L410-Q412 VanDerWaalsContact C-N 3.33Å; L410-Q412 PolarHBondContact O-N 3.13Å; L410-K413 WeakPolarHBondContact O-CB 3.36Å; L410-K413 PolarHBondContact O-N 3.48Å; L410-K413 VanDerWaalsContact O-N 3.16Å; L410-E414 WeakPolarHBondContact O-CG 3.41Å; L410-E414 PolarHBondContact O-N 2.88Å
411R89.7Confident83.7Confident170 Ų17097.7 Ų97.764%0.64247%0.47SS*.Hα-helixtrans-62.2-39176.1-72.5172.1175-166.8-3.7112.6K407 I408 K413 E414 R415K407-R411 VanDerWaalsContact O-CG 3.29Å; K407-R411 WeakPolarHBondContact O-CG 3.48Å; K407-R411 PolarHBondContact O-N 3.05Å; I408-R411 PolarHBondContact O-N 2.89Å; R411-K413 VanDerWaalsContact C-N 3.34Å; R411-E414 PolarHBondContact O-N 3.24Å; R411-R415 WeakPolarHBondContact O-CG 3.33Å; R411-R415 PolarHBondContact O-N 2.98Å
412Q88.9Confident82Confident95 Ų9599.2 Ų99.244%0.44449%0.488SS..Hα-helixtrans-67.5-36.6175.6-73.5177.1-2.600111.7I408 H409 L410 R415 K416I408-Q412 WeakPolarHBondContact O-CB 3.35Å; I408-Q412 VanDerWaalsContact O-CG 3.3Å; I408-Q412 WeakPolarHBondContact O-CG 3.39Å; I408-Q412 PolarHBondContact O-N 3.4Å; H409-Q412 PolarHBondContact O-N 3.42Å; L410-Q412 VanDerWaalsContact C-N 3.33Å; L410-Q412 PolarHBondContact O-N 3.13Å; Q412-R415 PolarHBondContact O-N 3.1Å; Q412-K416 WeakPolarHBondContact O-CG 3.21Å; Q412-K416 PolarHBondContact O-N 3.46Å
413K86.5Confident80.1Confident144 Ų144100.6 Ų100.663%0.62651%0.506SS*.Hα-helixtrans-64-44.9174.4-172.9-179.9179-178.60111.5H409 L410 R411 K416 A417H409-K413 WeakPolarHBondContact O-CB 3.32Å; H409-K413 PolarHBondContact O-N 3.24Å; L410-K413 WeakPolarHBondContact O-CB 3.36Å; L410-K413 PolarHBondContact O-N 3.48Å; L410-K413 VanDerWaalsContact O-N 3.16Å; R411-K413 VanDerWaalsContact C-N 3.34Å; K413-K416 PolarHBondContact O-N 3.47Å; K413-A417 WeakPolarHBondContact O-CB 3.5Å; K413-A417 PolarHBondContact O-N 3.15Å
414E83.4Confident78.2Confident123 Ų123100 Ų10058%0.57552%0.517SS*.Hα-helixtrans-62.2-42.7176.5-71.4168.6178.200112.1L410 R411 K416 A417 S418L410-E414 WeakPolarHBondContact O-CG 3.41Å; L410-E414 PolarHBondContact O-N 2.88Å; R411-E414 PolarHBondContact O-N 3.24Å; E414-K416 PolarHBondContact O-N 3.44Å; E414-A417 PolarHBondContact O-N 3.42Å; E414-S418 PolarHBondContact O-N 3.41Å; E414-S418 PolarHBondContact O-OG 3.07Å
415R83Confident76.2Confident194 Ų19498 Ų9873%0.73253%0.526SS*.Hα-helixtrans-61.3-44175.4-75.3178.6175.6-170.9-3.4112.4R411 Q412 S418 T419R411-R415 WeakPolarHBondContact O-CG 3.33Å; R411-R415 PolarHBondContact O-N 2.98Å; Q412-R415 PolarHBondContact O-N 3.1Å; R415-S418 PolarHBondContact O-N 3.27Å; R415-T419 PolarHBondContact O-N 3.42Å; R415-T419 PolarHBondContact O-OG1 3.31Å
416K76.8Confident74.2Confident149 Ų149102 Ų10265%0.64856%0.557SS**Hα-helixtrans-68.3-34.4178.1-71.6178.9-179.8-173.70112.9Q412 K413 E414 S418 T419 V420Q412-K416 WeakPolarHBondContact O-CG 3.21Å; Q412-K416 PolarHBondContact O-N 3.46Å; K413-K416 PolarHBondContact O-N 3.47Å; E414-K416 PolarHBondContact O-N 3.44Å; K416-S418 VanDerWaalsContact C-N 3.34Å; K416-T419 WeakPolarHBondContact CA-OG1 3.44Å; K416-T419 PolarHBondContact O-OG1 3.07Å; K416-V420 WeakPolarHBondContact O-CG2 3.37Å; K416-V420 PolarHBondContact O-N 3.44Å
417A75.1Confident72.1Confident58 Ų58104.2 Ų104.248%0.47958%0.584SS.*Hα-helixtrans-67.7-35.8174.400000112.1K413 E414 V420 S421K413-A417 WeakPolarHBondContact O-CB 3.5Å; K413-A417 PolarHBondContact O-N 3.15Å; E414-A417 PolarHBondContact O-N 3.42Å; A417-V420 PolarHBondContact O-N 3.09Å; A417-S421 PolarHBondContact O-N 3.08Å; A417-S421 PolarHBondContact O-OG 3.37Å
418S67.8Low70.1Confident75 Ų75103.6 Ų103.652%0.52460%0.596SS.*Hα-helixtrans-67.5-39.9178-52.60000111.9E414 R415 K416 V420 S421 S422E414-S418 PolarHBondContact O-N 3.41Å; E414-S418 PolarHBondContact O-OG 3.07Å; R415-S418 PolarHBondContact O-N 3.27Å; K416-S418 VanDerWaalsContact C-N 3.34Å; S418-V420 VanDerWaalsContact C-N 3.33Å; S418-V420 PolarHBondContact O-N 3.27Å; S418-S421 PolarHBondContact O-N 3.08Å; S418-S422 PolarHBondContact O-OG 3.07Å
419T61.8Low67.8Low93 Ų93105.7 Ų105.757%0.57162%0.617SS**Hα-helixtrans-68.6-28.1179.247.30000113.9R415 K416 S421R415-T419 PolarHBondContact O-N 3.42Å; R415-T419 PolarHBondContact O-OG1 3.31Å; K416-T419 WeakPolarHBondContact CA-OG1 3.44Å; K416-T419 PolarHBondContact O-OG1 3.07Å; T419-S421 VanDerWaalsContact C-N 3.29Å
420V59.9Low65.9Low102 Ų102108.9 Ų108.962%0.61865%0.65SS**Hα-helixtrans-77.5-18.8177.3177.90000111.8K416 A417 S418 S423K416-V420 WeakPolarHBondContact O-CG2 3.37Å; K416-V420 PolarHBondContact O-N 3.44Å; A417-V420 PolarHBondContact O-N 3.09Å; S418-V420 VanDerWaalsContact C-N 3.33Å; S418-V420 PolarHBondContact O-N 3.27Å; V420-S423 PolarHBondContact O-OG 3.49Å
421S55.9Low63.8Low91 Ų91113.7 Ų113.764%0.63668%0.675SS**Hα-helixtrans-81.5-16.2177.1-50.40000112.9A417 S418 T419A417-S421 PolarHBondContact O-N 3.08Å; A417-S421 PolarHBondContact O-OG 3.37Å; S418-S421 PolarHBondContact O-N 3.08Å; T419-S421 VanDerWaalsContact C-N 3.29Å
422S56.3Low61.6Low94 Ų94113 Ų11366%0.65768%0.68SS**SBendtrans-97.7-5.8-178.3-46.30000113.9S418S418-S422 PolarHBondContact O-OG 3.07Å
423S55.3Low59.4Low85 Ų85118 Ų11859%0.59469%0.694SS**SBendtrans-103.412.1-17656.40000114.4V420V420-S423 PolarHBondContact O-OG 3.49Å
424S53Low57.7Low106 Ų106115.9 Ų115.974%0.74170%0.696SS**SBendtrans-105.96.6178.6450000114.6
425S52.8Low56.1Low107 Ų107116.1 Ų116.175%0.74871%0.71SS**SBendtrans-119.650.4177.165.50000113.2
426S52.3Low54Low113 Ų113110.5 Ų110.579%0.7971%0.713SS**  trans-141.561.7161.657.30000109.5
427G49.2Very low52.4Low66 Ų66107 Ų10768%0.6872%0.72SS**  trans-86.4126.9157.700000109.4
428S50.4Low50.9Low118 Ų118112.8 Ų112.883%0.82574%0.741SS**  trans75.792.6148.7-46.70000118.2
429S44.7Very low49.6Very low126 Ų126115 Ų11588%0.88176%0.756SS**  trans-151.985.4132-74.60000108.1
430A51Low48.6Very low103 Ų103115.5 Ų115.585%0.85177%0.769SS**  trans-71.3117.9160.700000107.6
431L47.1Very low47.8Very low175 Ų175115.1 Ų115.192%0.91678%0.777SS**  trans-131.4119.4156.8-96.3163.6000108
432E41.6Very low47.2Very low157 Ų157116.8 Ų116.873%0.73479%0.789SS**  trans-70.7148.1-177-96.7-140.1113.400113.9
433R44.6Very low46.4Very low198 Ų198116 Ų11675%0.74780%0.796SS**  trans76.3163.5139.8-76.6174.276-158.73.9119.7
434P50.2Low46Very low101 Ų101119.7 Ų119.766%0.65681%0.807SS**  cis-135.7175-30.833-13.8000114.2
435S50.3Low45.4Very low127 Ų127120.6 Ų120.689%0.88881%0.812SS**  trans-39.2135.6165.8-26.80000115.8
436G38.8Very low45Very low76 Ų76124.4 Ų124.478%0.78484%0.839SS**  trans-166.4109.316500000110.1
437G41.5Very low44.7Very low77 Ų77125 Ų12579%0.79484%0.841SS**  trans-78.4157.917800000112.9
438I43.6Very low44.4Very low179 Ų179128.1 Ų128.192%0.91885%0.85SS**  trans-157.7135.7149.126.9169.6000109
439S42.4Very low44.1Very low120 Ų120128.7 Ų128.784%0.83985%0.851SS**  trans-78.1171.5-179.6-58.10000113.8
440A40.4Very low44.1Very low104 Ų104128.8 Ų128.886%0.8685%0.849SS**  trans84.6140.7164.300000115
441A41.7Very low43.6Very low95 Ų95130.4 Ų130.479%0.78585%0.849SS**  cis-155.916413.800000110.8
442S43.7Very low43.4Very low126 Ų126127.5 Ų127.588%0.88185%0.845SS**  trans-26.3143.8166.5-44.50000118.3
443G40.6Very low43.5Very low77 Ų77125.4 Ų125.479%0.79485%0.853SS**  trans-167.389.4164.800000111.3
444I47Very low43.4Very low162 Ų162119.8 Ų119.883%0.83186%0.861SS**  trans-70.9134170.9-61.5160000108
445C39.1Very low42.9Very low125 Ų125121.3 Ų121.385%0.84588%0.878SS**  trans-136.5128.1155.259.80000109.6
446S45.5Very low42.2Very low188 Ų188120.8 Ų120.8100%1.31588%0.877SS**  trans-69.30-173.6-56.80000115

Retrieved 446 of 446 residues in 84.8 ms (Link to these results)